A0A3Q0KKX6_SCHMA Loading...

Protein arginine methyltransferase NDUFAF7

Arginine methyltransferase involved in the assembly or stability of mitochondrial NADH:ubiquinone oxidoreductase complex (complex I).

AlphaFold DB (A0A5K4ELG7), UniProt , Accession A0A3Q0KKX6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 424 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.6	Very low	32	Very low	234 Å²	234	174.7 Å²	174.7	100%	1.153	86%	0.861	S	S	*	*				0	95.8	0	-85.4	177.3	177.3	0	0	107.8
2	F	33.1	Very low	31.9	Very low	191 Å²	191	168 Å²	168	84%	0.838	84%	0.844	S	S	*	*			trans	-114.2	91.6	-179.7	-75.3	-73.9	0	0	0	109	F4	F2-F4 HydrophobicContact CD1-CD2 4.27Å; F2-F4 AromaticContact CD1-CE2 3.87Å; F2-F4 HydrophobicContact CD1-CE2 3.87Å; F2-F4 HydrophobicContact CE1-CE2 4.49Å
3	H	28.9	Very low	31.8	Very low	192 Å²	192	164 Å²	164	89%	0.889	84%	0.842	S	S	*	*			trans	-81.3	111.6	158.6	-96.6	-36.3	0	0	0	107.2
4	F	36.4	Very low	31.9	Very low	183 Å²	183	163.9 Å²	163.9	80%	0.803	84%	0.842	S	S	*	*			trans	-121.5	131.9	164	-89.2	-77.2	0	0	0	110.3	F2	F2-F4 HydrophobicContact CD1-CD2 4.27Å; F2-F4 AromaticContact CD1-CE2 3.87Å; F2-F4 HydrophobicContact CD1-CE2 3.87Å; F2-F4 HydrophobicContact CE1-CE2 4.49Å
5	S	32.2	Very low	31.6	Very low	113 Å²	113	160.8 Å²	160.8	79%	0.79	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-75.5	151.5	-161.6	-41.3	0	0	0	0	113.2
6	K	30.2	Very low	31.6	Very low	204 Å²	204	157.7 Å²	157.7	89%	0.887	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-51.4	136	176.2	-69.4	175.8	173.9	178	0	113.1
7	P	34.2	Very low	31.6	Very low	126 Å²	126	157.1 Å²	157.1	82%	0.818	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.3	132.3	166	30	-26.6	0	0	0	110.6
8	R	31	Very low	31.6	Very low	239 Å²	239	155.6 Å²	155.6	90%	0.902	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-70.6	134.6	173.5	-83.4	178.3	168.8	175.8	-3.8	110.4	V10	R8-V10 PolarHBondContact O-N 2.79Å
9	I	29.5	Very low	31.6	Very low	147 Å²	147	156.8 Å²	156.8	75%	0.754	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-64.1	120.4	171.2	-66	162.6	0	0	0	109	L11	I9-L11 HydrophobicContact CG2-CD1 4.1Å; I9-L11 HydrophobicContact CG2-CG 3.79Å
10	V	32.1	Very low	31.6	Very low	128 Å²	128	154.1 Å²	154.1	78%	0.776	82%	0.822	S	S	*	*			trans	-103.8	101.7	164.1	178.8	0	0	0	0	106.7	R8 S12	R8-V10 PolarHBondContact O-N 2.79Å; V10-S12 PolarHBondContact O-N 3.37Å
11	L	28.4	Very low	31.5	Very low	165 Å²	165	149.2 Å²	149.2	86%	0.864	81%	0.808	S	S	*	*			trans	-78.2	96.4	170.2	-79.1	152.6	0	0	0	108	I9	I9-L11 HydrophobicContact CG2-CD1 4.1Å; I9-L11 HydrophobicContact CG2-CG 3.79Å
12	S	31.4	Very low	31.4	Very low	94 Å²	94	147.3 Å²	147.3	66%	0.657	79%	0.788	S	S	*	*			trans	-100.7	117.7	164.3	62	0	0	0	0	109.6	V10 L14	V10-S12 PolarHBondContact O-N 3.37Å; S12-L14 PolarHBondContact O-N 3.32Å
13	S	30.1	Very low	31.5	Very low	116 Å²	116	148.6 Å²	148.6	81%	0.811	79%	0.789	S	S	*	*			trans	-43.6	113.6	172.9	51	0	0	0	0	114
14	L	33.5	Very low	32	Very low	163 Å²	163	147.5 Å²	147.5	85%	0.853	78%	0.782	S	S	*	*			trans	-112.8	94.4	156.1	-82.3	159.2	0	0	0	107.1	S12 C16	S12-L14 PolarHBondContact O-N 3.32Å; L14-C16 PolarHBondContact O-N 3.49Å
15	S	27.3	Very low	32.2	Very low	117 Å²	117	142.9 Å²	142.9	82%	0.818	77%	0.773	S	S	*	*			trans	-66.6	82.5	164.3	53.9	0	0	0	0	108.5
16	C	31.4	Very low	32.8	Very low	111 Å²	111	142.1 Å²	142.1	75%	0.75	77%	0.767	S	S	*	*			trans	-91.4	104.8	168.3	-135.7	0	0	0	0	107.3	L14 T18	L14-C16 PolarHBondContact O-N 3.49Å; C16-T18 PolarHBondContact O-N 3.18Å
17	I	32.1	Very low	33.8	Very low	148 Å²	148	138.6 Å²	138.6	76%	0.759	77%	0.765	S	S	*	*			trans	-54.4	107.7	176.9	-66.9	165	0	0	0	108.2	H19	I17-H19 HydrophobicContact CG2-CB 4.45Å; I17-H19 PolarHBondContact O-N 3.25Å
18	T	32.5	Very low	35.2	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	74%	0.741	S	S	*	*			trans	-73.2	78.4	169.3	41.9	0	0	0	0	108.9	C16 C20	C16-T18 PolarHBondContact O-N 3.18Å; T18-C20 PolarHBondContact O-N 2.91Å
19	H	30.1	Very low	37.4	Very low	178 Å²	178	127.6 Å²	127.6	82%	0.824	72%	0.72	S	S	*	*			trans	-77.1	69.9	161.1	-120.4	37.8	0	0	0	108.6	I17 G21	I17-H19 HydrophobicContact CG2-CB 4.45Å; I17-H19 PolarHBondContact O-N 3.25Å; H19-G21 PolarHBondContact O-N 3.31Å
20	C	32.9	Very low	39.7	Very low	103 Å²	103	124.7 Å²	124.7	70%	0.696	70%	0.703	S	S	*	*			trans	-80.3	64	165.1	-156.9	0	0	0	0	108.2	T18 R22	T18-C20 PolarHBondContact O-N 2.91Å; C20-R22 PolarHBondContact O-N 2.99Å
21	G	29.6	Very low	42.1	Very low	52 Å²	52	125.5 Å²	125.5	54%	0.536	70%	0.698	S	S	.	*			trans	-77.1	68.4	170.1	0	0	0	0	0	109.5	H19 Y23	H19-G21 PolarHBondContact O-N 3.31Å; G21-Y23 PolarHBondContact O-N 3.37Å; G21-Y23 VanDerWaalsContact O-N 3.12Å
22	R	33	Very low	44.9	Very low	193 Å²	193	121.9 Å²	121.9	73%	0.728	68%	0.677	S	S	*	*			trans	-79.7	83.2	160.4	-74.2	-169.9	-179.1	176.6	-2.7	107.2	C20 F24	C20-R22 PolarHBondContact O-N 2.99Å; R22-F24 HydrophobicContact CB-CD2 4.04Å; R22-F24 HydrophobicContact CB-CE2 4.07Å; R22-F24 HydrophobicContact CG-CE2 4.41Å; R22-F24 PolarHBondContact O-N 3.44Å
23	Y	35.3	Very low	47.6	Very low	219 Å²	219	118.9 Å²	118.9	86%	0.859	65%	0.654	S	S	*	*			trans	-66	83.6	157.8	-65.4	-86.8	0	0	0	106.9	G21 S25	G21-Y23 PolarHBondContact O-N 3.37Å; G21-Y23 VanDerWaalsContact O-N 3.12Å; Y23-S25 VanDerWaalsContact C-N 3.27Å; Y23-S25 PolarHBondContact O-N 3.42Å
24	F	38.3	Very low	50.5	Low	169 Å²	169	113.5 Å²	113.5	74%	0.741	62%	0.616	S	S	*	*			trans	-73.5	99.3	150.9	-74.7	-78.6	0	0	0	104.4	R22 S26	R22-F24 HydrophobicContact CB-CD2 4.04Å; R22-F24 HydrophobicContact CB-CE2 4.07Å; R22-F24 HydrophobicContact CG-CE2 4.41Å; R22-F24 PolarHBondContact O-N 3.44Å; F24-S26 PolarHBondContact O-N 3.28Å
25	S	41	Very low	53.4	Low	86 Å²	86	110.7 Å²	110.7	60%	0.601	60%	0.598	S	S	*	*			trans	-47.7	138.9	155.7	33.7	0	0	0	0	107.2	Y23	Y23-S25 VanDerWaalsContact C-N 3.27Å; Y23-S25 PolarHBondContact O-N 3.42Å
26	S	44.5	Very low	56.6	Low	97 Å²	97	107.1 Å²	107.1	68%	0.678	57%	0.572	S	S	*	*			trans	-42.5	138.4	166	46.6	0	0	0	0	108.8	F24 E28	F24-S26 PolarHBondContact O-N 3.28Å; S26-E28 PolarHBondContact O-N 3.32Å
27	P	51.5	Low	59.6	Low	129 Å²	129	101.9 Å²	101.9	84%	0.838	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-49.7	117.9	-178.1	18.7	-29.6	0	0	0	108.2
28	E	64	Low	62.7	Low	70 Å²	70	96.2 Å²	96.2	33%	0.327	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-52.7	146.7	177	-67.2	-174.4	161.1	0	0	108.2	S26 Q32 L33	S26-E28 PolarHBondContact O-N 3.32Å; E28-Q32 HydrophobicContact CB-CB 4.22Å; E28-Q32 HydrophobicContact CB-CG 4.12Å; E28-Q32 VanDerWaalsContact CD-NE2 3.3Å; E28-Q32 HydrophobicContact CG-CG 4.38Å; E28-Q32 PolarHBondContact OE1-NE2 3.23Å; E28-Q32 VanDerWaalsContact OE1-NE2 3.15Å; E28-L33 HydrophobicContact CB-CD2 3.98Å; E28-L33 HydrophobicContact CB-CG 4.12Å; E28-L33 WeakPolarHBondContact OE2-CD2 3.5Å
29	S	77.8	Confident	65.7	Low	64 Å²	64	96.2 Å²	96.2	45%	0.448	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-58.8	150.5	175.4	67.4	0	0	0	0	109.4	E31 Q32 L33	S29-E31 PolarHBondContact O-N 2.84Å; S29-Q32 WeakPolarHBondContact O-CA 3.34Å; S29-Q32 WeakPolarHBondContact O-CB 3.35Å; S29-Q32 PolarHBondContact O-N 2.95Å; S29-Q32 WeakPolarHBondContact OG-CB 3.47Å; S29-Q32 PolarHBondContact OG-N 2.87Å; S29-L33 PolarHBondContact O-N 3.26Å
30	Q	76.8	Confident	68.8	Low	86 Å²	86	91.2 Å²	91.2	40%	0.402	47%	0.472	S	S	.	.	H	α-helix	trans	-55.4	-36.7	178.4	-70.8	-179.1	-29.9	0	0	112.3	L33 S34 H72 H310	Q30-L33 PolarHBondContact O-N 2.99Å; Q30-S34 PolarHBondContact O-N 3.1Å; Q30-H72 PolarHBondContact NE2-CD2 3.44Å; Q30-H310 PolarHBondContact OE1-NE2 2.88Å
31	E	82.5	Confident	71.9	Confident	145 Å²	145	86.5 Å²	86.5	68%	0.678	44%	0.44	S	S	*	.	H	α-helix	trans	-62.1	-41.9	173.8	-67.5	174.6	-177.4	0	0	112	S29 S34 E35	S29-E31 PolarHBondContact O-N 2.84Å; E31-S34 PolarHBondContact O-N 3.43Å; E31-E35 PolarHBondContact O-N 3.12Å
32	Q	86.5	Confident	75.1	Confident	90 Å²	90	84.7 Å²	84.7	42%	0.421	42%	0.418	S	S	.	.	H	α-helix	trans	-66.8	-37.8	177.9	-178.8	177.5	-7.5	0	0	112.3	E28 S29 S34 T36	E28-Q32 HydrophobicContact CB-CB 4.22Å; E28-Q32 HydrophobicContact CB-CG 4.12Å; E28-Q32 VanDerWaalsContact CD-NE2 3.3Å; E28-Q32 HydrophobicContact CG-CG 4.38Å; E28-Q32 PolarHBondContact OE1-NE2 3.23Å; E28-Q32 VanDerWaalsContact OE1-NE2 3.15Å; S29-Q32 WeakPolarHBondContact O-CA 3.34Å; S29-Q32 WeakPolarHBondContact O-CB 3.35Å; S29-Q32 PolarHBondContact O-N 2.95Å; S29-Q32 WeakPolarHBondContact OG-CB 3.47Å; S29-Q32 PolarHBondContact OG-N 2.87Å; Q32-S34 VanDerWaalsContact C-N 3.34Å; Q32-T36 WeakPolarHBondContact O-CB 3.48Å; Q32-T36 PolarHBondContact O-N 3.07Å; Q32-T36 PolarHBondContact O-OG1 3.08Å
33	L	89.2	Confident	78.1	Confident	31 Å²	31	80.3 Å²	80.3	16%	0.162	41%	0.406	C	S	.	.	H	α-helix	trans	-62.9	-42.4	173.6	-66.7	174.9	0	0	0	111.1	E28 S29 Q30 T36 L37 Y66 T71	E28-L33 HydrophobicContact CB-CD2 3.98Å; E28-L33 HydrophobicContact CB-CG 4.12Å; E28-L33 WeakPolarHBondContact OE2-CD2 3.5Å; S29-L33 PolarHBondContact O-N 3.26Å; Q30-L33 PolarHBondContact O-N 2.99Å; L33-T36 PolarHBondContact O-N 2.72Å; L33-L37 PolarHBondContact O-N 2.88Å; L33-Y66 HydrophobicContact CB-CD1 4.4Å; L33-Y66 HydrophobicContact CD2-CD1 3.97Å; L33-Y66 HydrophobicContact CD2-CE1 4.2Å; L33-T71 HydrophobicContact CD1-CG2 4.11Å
34	S	91.2	Very high	81	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-47.6	177.6	-168.3	0	0	0	0	112.4	Q30 E31 Q32 T36 L37 K38 N307 P308	Q30-S34 PolarHBondContact O-N 3.1Å; E31-S34 PolarHBondContact O-N 3.43Å; Q32-S34 VanDerWaalsContact C-N 3.34Å; S34-T36 VanDerWaalsContact C-N 3.3Å; S34-T36 PolarHBondContact O-N 3.49Å; S34-L37 PolarHBondContact O-N 2.98Å; S34-K38 WeakPolarHBondContact O-CB 3.33Å; S34-K38 PolarHBondContact O-N 3.42Å; S34-N307 VanDerWaalsContact OG-C 3.27Å; S34-N307 WeakPolarHBondContact OG-CA 3.43Å; S34-P308 WeakPolarHBondContact CA-O 3.48Å; S34-P308 WeakPolarHBondContact CB-O 3.41Å; S34-P308 PolarHBondContact OG-O 3.31Å
35	E	93	Very high	83.8	Confident	103 Å²	103	66 Å²	66	48%	0.481	35%	0.346	S	S	.	.	H	α-helix	trans	-62.8	-37.5	177	-74.8	-60	133.1	0	0	112.1	E31 K38 K39	E31-E35 PolarHBondContact O-N 3.12Å; E35-K38 PolarHBondContact O-N 2.83Å; E35-K39 WeakPolarHBondContact O-CB 3.45Å; E35-K39 PolarHBondContact O-N 2.95Å
36	T	94.9	Very high	86.3	Confident	42 Å²	42	67.1 Å²	67.1	26%	0.258	35%	0.345	S	S	.	.	H	α-helix	trans	-64.7	-45.7	175.7	-60.9	0	0	0	0	111.6	Q32 L33 S34 K39 Q40 Y66	Q32-T36 WeakPolarHBondContact O-CB 3.48Å; Q32-T36 PolarHBondContact O-N 3.07Å; Q32-T36 PolarHBondContact O-OG1 3.08Å; L33-T36 PolarHBondContact O-N 2.72Å; S34-T36 VanDerWaalsContact C-N 3.3Å; S34-T36 PolarHBondContact O-N 3.49Å; T36-K39 PolarHBondContact O-N 3.28Å; T36-Q40 WeakPolarHBondContact O-CG 3.36Å; T36-Q40 PolarHBondContact O-N 3.08Å; T36-Q40 VanDerWaalsContact O-N 3.09Å; T36-Y66 HydrophobicContact CG2-CE1 3.77Å
37	L	95.6	Very high	88.8	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-45.9	176.2	179.3	59.2	0	0	0	111.4	L33 S34 K39 Q40 L41 Y66 P308	L33-L37 PolarHBondContact O-N 2.88Å; S34-L37 PolarHBondContact O-N 2.98Å; L37-K39 VanDerWaalsContact C-N 3.29Å; L37-K39 PolarHBondContact O-N 3.45Å; L37-Q40 PolarHBondContact O-N 3.32Å; L37-Q40 VanDerWaalsContact O-N 3.12Å; L37-L41 HydrophobicContact CD1-CD1 4.31Å; L37-L41 HydrophobicContact CD1-CG 4.2Å; L37-L41 HydrophobicContact CG-CD1 4.01Å; L37-L41 HydrophobicContact CG-CG 4.36Å; L37-L41 WeakPolarHBondContact O-CG 3.31Å; L37-L41 PolarHBondContact O-N 2.97Å; L37-Y66 HydrophobicContact CB-CG 4.13Å; L37-Y66 HydrophobicContact CD1-CD2 4.15Å; L37-Y66 HydrophobicContact CD1-CG 4.44Å; L37-P308 HydrophobicContact CD2-CB 4.01Å; L37-P308 HydrophobicContact CG-CB 4.2Å
38	K	96.3	Very high	90.9	Very high	29 Å²	29	69 Å²	69	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-56	-44.5	177.1	-175.2	175	-177.5	170.2	0	111.8	S34 E35 L41 L42 N224 I306 P308	S34-K38 WeakPolarHBondContact O-CB 3.33Å; S34-K38 PolarHBondContact O-N 3.42Å; E35-K38 PolarHBondContact O-N 2.83Å; K38-L41 PolarHBondContact O-N 3.31Å; K38-L42 HydrophobicContact CG-CD1 4.25Å; K38-L42 WeakPolarHBondContact O-CG 3.44Å; K38-L42 PolarHBondContact O-N 3.1Å; K38-N224 VanDerWaalsContact CE-O 3.25Å; K38-N224 WeakPolarHBondContact CE-O 3.39Å; K38-I306 PolarHBondContact NZ-O 3.16Å; K38-P308 HydrophobicContact CB-CG 3.95Å; K38-P308 HydrophobicContact CG-CG 4.18Å
39	K	95.3	Very high	92.4	Very high	131 Å²	131	67 Å²	67	57%	0.57	33%	0.334	S	S	*	.	H	α-helix	trans	-60.2	-46.4	175.2	-177	179.5	172.5	-176.1	0	112	E35 T36 L37 L41 L42 E43	E35-K39 WeakPolarHBondContact O-CB 3.45Å; E35-K39 PolarHBondContact O-N 2.95Å; T36-K39 PolarHBondContact O-N 3.28Å; L37-K39 VanDerWaalsContact C-N 3.29Å; L37-K39 PolarHBondContact O-N 3.45Å; K39-L41 VanDerWaalsContact C-N 3.34Å; K39-L41 PolarHBondContact O-N 2.67Å; K39-L42 PolarHBondContact O-N 2.66Å; K39-E43 WeakPolarHBondContact CE-OE1 3.48Å; K39-E43 WeakPolarHBondContact O-CG 3.46Å; K39-E43 PolarHBondContact O-N 3.37Å
40	Q	95.7	Very high	93.3	Very high	72 Å²	72	66.8 Å²	66.8	34%	0.336	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-40.2	177.9	-71.1	173.8	20.8	0	0	112.3	T36 L37 E43 R44 Y66	T36-Q40 WeakPolarHBondContact O-CG 3.36Å; T36-Q40 PolarHBondContact O-N 3.08Å; T36-Q40 VanDerWaalsContact O-N 3.09Å; L37-Q40 PolarHBondContact O-N 3.32Å; L37-Q40 VanDerWaalsContact O-N 3.12Å; Q40-E43 PolarHBondContact O-N 3.35Å; Q40-R44 WeakPolarHBondContact O-CB 3.32Å; Q40-R44 PolarHBondContact O-N 3.22Å; Q40-Y66 PolarHBondContact NE2-OH 3.14Å; Q40-Y66 VanDerWaalsContact NE2-OH 3.16Å
41	L	97.4	Very high	94.3	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-44.3	176	-68.1	171.6	0	0	0	111.3	L37 K38 K39 R44 I45 L51 Y56 E59 P308	L37-L41 HydrophobicContact CD1-CD1 4.31Å; L37-L41 HydrophobicContact CD1-CG 4.2Å; L37-L41 HydrophobicContact CG-CD1 4.01Å; L37-L41 HydrophobicContact CG-CG 4.36Å; L37-L41 WeakPolarHBondContact O-CG 3.31Å; L37-L41 PolarHBondContact O-N 2.97Å; K38-L41 PolarHBondContact O-N 3.31Å; K39-L41 VanDerWaalsContact C-N 3.34Å; K39-L41 PolarHBondContact O-N 2.67Å; L41-R44 PolarHBondContact O-N 3.17Å; L41-I45 WeakPolarHBondContact O-CB 3.28Å; L41-I45 WeakPolarHBondContact O-CD1 3.47Å; L41-I45 VanDerWaalsContact O-CG1 3.23Å; L41-I45 WeakPolarHBondContact O-CG1 3.3Å; L41-I45 PolarHBondContact O-N 2.64Å; L41-L51 HydrophobicContact CD2-CD1 3.77Å; L41-Y56 HydrophobicContact CD1-CD2 3.94Å; L41-Y56 HydrophobicContact CD1-CE2 3.71Å; L41-E59 HydrophobicContact CD2-CB 4.09Å; L41-E59 HydrophobicContact CD2-CG 4.14Å; L41-P308 HydrophobicContact CD1-CB 3.88Å; L41-P308 HydrophobicContact CD1-CG 4.25Å
42	L	97	Very high	95.1	Very high	13 Å²	13	57 Å²	57	7%	0.068	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-43.4	175.6	-73	167.9	0	0	0	112.1	K38 K39 I45 N46 N224 L226	K38-L42 HydrophobicContact CG-CD1 4.25Å; K38-L42 WeakPolarHBondContact O-CG 3.44Å; K38-L42 PolarHBondContact O-N 3.1Å; K39-L42 PolarHBondContact O-N 2.66Å; L42-I45 PolarHBondContact O-N 3.04Å; L42-N46 WeakPolarHBondContact O-CB 3.32Å; L42-N46 PolarHBondContact O-N 3.04Å; L42-N46 PolarHBondContact O-ND2 2.84Å; L42-N224 HydrophobicContact CD1-CB 4.2Å; L42-L226 HydrophobicContact CD2-CD2 3.64Å; L42-L226 HydrophobicContact CD2-CG 4.33Å; L42-L226 HydrophobicContact CG-CD2 4.13Å
43	E	95.7	Very high	95.7	Very high	101 Å²	101	52.8 Å²	52.8	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-43.9	175.8	-74.9	174.7	-178.6	0	0	111.6	K39 Q40 N46 T47	K39-E43 WeakPolarHBondContact CE-OE1 3.48Å; K39-E43 WeakPolarHBondContact O-CG 3.46Å; K39-E43 PolarHBondContact O-N 3.37Å; Q40-E43 PolarHBondContact O-N 3.35Å; E43-N46 PolarHBondContact O-N 3.1Å; E43-T47 WeakPolarHBondContact O-CB 3.39Å; E43-T47 PolarHBondContact O-N 2.68Å; E43-T47 VanDerWaalsContact O-N 3.09Å; E43-T47 PolarHBondContact O-OG1 3.47Å
44	R	96.7	Very high	96.1	Very high	82 Å²	82	52.2 Å²	52.2	31%	0.309	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-45.7	174.8	-174.5	176.7	169.5	-174.5	-9.2	111.3	Q40 L41 T47 F48 L51 E55 E59	Q40-R44 WeakPolarHBondContact O-CB 3.32Å; Q40-R44 PolarHBondContact O-N 3.22Å; L41-R44 PolarHBondContact O-N 3.17Å; R44-T47 PolarHBondContact O-N 3.28Å; R44-F48 HydrophobicContact CG-CD2 4.04Å; R44-F48 WeakPolarHBondContact O-CD2 3.28Å; R44-F48 PolarHBondContact O-N 3.37Å; R44-L51 HydrophobicContact CG-CD2 4.16Å; R44-E55 IonicContact NH2-OE1 2.71Å; R44-E55 PolarHBondContact NH2-OE1 3.19Å; R44-E59 IonicContact NH1-OE1 2.81Å
45	I	97.1	Very high	96.4	Very high	6 Å²	6	55.3 Å²	55.3	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-45.9	179.1	-72	163.2	0	0	0	111.4	L41 L42 T47 G49 L51 V217 L226	L41-I45 WeakPolarHBondContact O-CB 3.28Å; L41-I45 WeakPolarHBondContact O-CD1 3.47Å; L41-I45 VanDerWaalsContact O-CG1 3.23Å; L41-I45 WeakPolarHBondContact O-CG1 3.3Å; L41-I45 PolarHBondContact O-N 2.64Å; L42-I45 PolarHBondContact O-N 3.04Å; I45-T47 PolarHBondContact O-N 3.24Å; I45-G49 WeakPolarHBondContact CA-O 3.26Å; I45-G49 CarbonylContact O-C 3.54Å; I45-G49 WeakPolarHBondContact O-CA 3.46Å; I45-G49 PolarHBondContact O-N 3.1Å; I45-L51 HydrophobicContact CD1-CD1 4.2Å; I45-L51 HydrophobicContact CD1-CG 4.3Å; I45-L51 HydrophobicContact CG1-CD1 4.02Å; I45-L51 HydrophobicContact CG1-CG 3.77Å; I45-V217 HydrophobicContact CD1-CG1 4.4Å; I45-L226 HydrophobicContact CD1-CD2 3.59Å
46	N	94.6	Very high	96.7	Very high	110 Å²	110	50.4 Å²	50.4	59%	0.588	26%	0.257	S	S	*	.	H	α-helix	trans	-66.6	-24.4	-179.7	-68.3	-24.8	0	0	0	112.4	L42 E43 S219	L42-N46 WeakPolarHBondContact O-CB 3.32Å; L42-N46 PolarHBondContact O-N 3.04Å; L42-N46 PolarHBondContact O-ND2 2.84Å; E43-N46 PolarHBondContact O-N 3.1Å; N46-S219 PolarHBondContact OD1-OG 2.79Å
47	T	95.5	Very high	96.8	Very high	97 Å²	97	48.4 Å²	48.4	60%	0.595	25%	0.245	S	C	*	.	H	α-helix	trans	-90	-43.5	-179.5	-53.9	0	0	0	0	112.8	E43 R44 I45	E43-T47 WeakPolarHBondContact O-CB 3.39Å; E43-T47 PolarHBondContact O-N 2.68Å; E43-T47 VanDerWaalsContact O-N 3.09Å; E43-T47 PolarHBondContact O-OG1 3.47Å; R44-T47 PolarHBondContact O-N 3.28Å; I45-T47 PolarHBondContact O-N 3.24Å
48	F	95.9	Very high	96.9	Very high	169 Å²	169	54.1 Å²	54.1	74%	0.741	27%	0.27	S	S	*	.	H	α-helix	trans	-115.8	-4.1	-169	-59.2	-70.3	0	0	0	114.1	R44	R44-F48 HydrophobicContact CG-CD2 4.04Å; R44-F48 WeakPolarHBondContact O-CD2 3.28Å; R44-F48 PolarHBondContact O-N 3.37Å
49	G	95.5	Very high	96.9	Very high	27 Å²	27	55.2 Å²	55.2	28%	0.278	28%	0.275	S	S	.	.			trans	92.3	-179.3	-174.6	0	0	0	0	0	113.5	I45	I45-G49 WeakPolarHBondContact CA-O 3.26Å; I45-G49 CarbonylContact O-C 3.54Å; I45-G49 WeakPolarHBondContact O-CA 3.46Å; I45-G49 PolarHBondContact O-N 3.1Å
50	P	97.7	Very high	96.9	Very high	59 Å²	59	49 Å²	49	38%	0.383	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-58.1	145.8	-175.1	-24.2	34.2	0	0	0	113.5	L216 V217 V229	P50-L216 HydrophobicContact CB-CB 3.8Å; P50-L216 HydrophobicContact CB-CD1 4.04Å; P50-V217 CarbonylContact C-O 3.49Å; P50-V217 WeakPolarHBondContact CA-O 3.29Å; P50-V229 HydrophobicContact CB-CG2 4.14Å; P50-V229 HydrophobicContact CG-CG2 4.14Å
51	L	98.1	Very high	96.8	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	150.4	175.1	-61.7	175.7	0	0	0	110.8	L41 R44 I45 E55 L216 V217	L41-L51 HydrophobicContact CD2-CD1 3.77Å; R44-L51 HydrophobicContact CG-CD2 4.16Å; I45-L51 HydrophobicContact CD1-CD1 4.2Å; I45-L51 HydrophobicContact CD1-CG 4.3Å; I45-L51 HydrophobicContact CG1-CD1 4.02Å; I45-L51 HydrophobicContact CG1-CG 3.77Å; L51-E55 HydrophobicContact CB-CB 4.43Å; L51-L216 CarbonylContact O-C 3.45Å; L51-L216 WeakPolarHBondContact O-CA 3.36Å; L51-L216 VanDerWaalsContact O-CB 3.3Å; L51-L216 WeakPolarHBondContact O-CB 3.23Å; L51-V217 PolarHBondContact N-O 2.88Å; L51-V217 PolarHBondContact O-N 3.39Å
52	T	98.3	Very high	96.5	Very high	22 Å²	22	47.4 Å²	47.4	14%	0.135	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	152.3	163.8	62.3	0	0	0	0	110.1	S54 E55 Y56 E214 L216	T52-S54 PolarHBondContact O-N 2.98Å; T52-E55 PolarHBondContact N-OE2 3.26Å; T52-E55 PolarHBondContact O-N 3.39Å; T52-E55 WeakPolarHBondContact OG1-CB 3.37Å; T52-E55 WeakPolarHBondContact OG1-CG 3.34Å; T52-E55 PolarHBondContact OG1-N 3.1Å; T52-E55 VanDerWaalsContact OG1-N 3.07Å; T52-E55 PolarHBondContact OG1-OE2 3.09Å; T52-Y56 PolarHBondContact O-N 3.32Å; T52-E214 VanDerWaalsContact CG2-OE1 3.3Å; T52-E214 WeakPolarHBondContact CG2-OE1 3.31Å; T52-L216 HydrophobicContact CG2-CD2 3.99Å
53	V	98.4	Very high	96.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-34.4	172	172.6	0	0	0	0	110.8	Y56 M57 V202 R204 V215 V217 F228 F293	V53-Y56 WeakPolarHBondContact O-CB 3.25Å; V53-Y56 PolarHBondContact O-N 2.83Å; V53-M57 HydrophobicContact CG1-CG 4.23Å; V53-M57 HydrophobicContact CG1-SD 4.15Å; V53-M57 WeakPolarHBondContact O-CB 3.46Å; V53-M57 WeakPolarHBondContact O-CG 3.3Å; V53-M57 PolarHBondContact O-N 3.32Å; V53-V202 CarbonylContact C-O 3.59Å; V53-V202 HydrophobicContact CG1-CG2 4.44Å; V53-R204 HydrophobicContact CB-CG 4.45Å; V53-R204 HydrophobicContact CG1-CG 4.28Å; V53-R204 HydrophobicContact CG2-CB 4.36Å; V53-R204 HydrophobicContact CG2-CG 4.49Å; V53-V215 HydrophobicContact CG2-CG1 4.41Å; V53-V215 WeakPolarHBondContact CG2-O 3.28Å; V53-V217 HydrophobicContact CG2-CG2 4.13Å; V53-F228 HydrophobicContact CG2-CD1 4.37Å; V53-F228 HydrophobicContact CG2-CE1 4.04Å; V53-F293 HydrophobicContact CG1-CD1 4.16Å; V53-F293 HydrophobicContact CG1-CE1 3.97Å; V53-F293 HydrophobicContact CG1-CE2 4.38Å; V53-F293 HydrophobicContact CG1-CG 4.42Å; V53-F293 HydrophobicContact CG1-CZ 4.09Å
54	S	98.2	Very high	95.8	Very high	19 Å²	19	48.1 Å²	48.1	13%	0.133	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-51.7	174.8	178.5	0	0	0	0	112.1	T52 Y56 M57 K58 P201 V202 H203	T52-S54 PolarHBondContact O-N 2.98Å; S54-Y56 VanDerWaalsContact C-N 3.32Å; S54-Y56 PolarHBondContact O-N 3.48Å; S54-M57 PolarHBondContact O-N 3.04Å; S54-K58 WeakPolarHBondContact O-CB 3.4Å; S54-K58 PolarHBondContact O-N 3.04Å; S54-P201 WeakPolarHBondContact O-CB 3.27Å; S54-P201 VanDerWaalsContact OG-CB 3.26Å; S54-P201 WeakPolarHBondContact OG-CB 3.47Å; S54-V202 VanDerWaalsContact CA-O 3.24Å; S54-V202 WeakPolarHBondContact CA-O 3.22Å; S54-V202 WeakPolarHBondContact CB-O 3.44Å; S54-V202 PolarHBondContact N-O 2.93Å; S54-H203 WeakPolarHBondContact CB-NE2 3.43Å; S54-H203 PolarHBondContact OG-NE2 2.9Å
55	E	98	Very high	95.5	Very high	68 Å²	68	49.7 Å²	49.7	32%	0.318	27%	0.272	S	S	.	.	H	α-helix	trans	-61	-42.3	176	-73.1	166	122.4	0	0	111.9	R44 L51 T52 K58 E59	R44-E55 IonicContact NH2-OE1 2.71Å; R44-E55 PolarHBondContact NH2-OE1 3.19Å; L51-E55 HydrophobicContact CB-CB 4.43Å; T52-E55 PolarHBondContact N-OE2 3.26Å; T52-E55 PolarHBondContact O-N 3.39Å; T52-E55 WeakPolarHBondContact OG1-CB 3.37Å; T52-E55 WeakPolarHBondContact OG1-CG 3.34Å; T52-E55 PolarHBondContact OG1-N 3.1Å; T52-E55 VanDerWaalsContact OG1-N 3.07Å; T52-E55 PolarHBondContact OG1-OE2 3.09Å; E55-K58 PolarHBondContact O-N 2.89Å; E55-E59 WeakPolarHBondContact O-CG 3.43Å; E55-E59 PolarHBondContact O-N 2.81Å
56	Y	98.5	Very high	95.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-48.5	177.3	177.6	-98.9	0	0	0	112.2	L41 T52 V53 S54 K58 E59 C60 V217 L226 F293 P304 L305 P308 L313	L41-Y56 HydrophobicContact CD1-CD2 3.94Å; L41-Y56 HydrophobicContact CD1-CE2 3.71Å; T52-Y56 PolarHBondContact O-N 3.32Å; V53-Y56 WeakPolarHBondContact O-CB 3.25Å; V53-Y56 PolarHBondContact O-N 2.83Å; S54-Y56 VanDerWaalsContact C-N 3.32Å; S54-Y56 PolarHBondContact O-N 3.48Å; Y56-K58 VanDerWaalsContact C-N 3.35Å; Y56-K58 PolarHBondContact O-N 3.33Å; Y56-E59 PolarHBondContact O-N 3.2Å; Y56-C60 VanDerWaalsContact CE2-SG 3.57Å; Y56-C60 WeakPolarHBondContact O-CB 3.35Å; Y56-C60 PolarHBondContact O-N 2.59Å; Y56-C60 PolarHBondContact O-SG 3.06Å; Y56-V217 HydrophobicContact CD1-CG2 4.31Å; Y56-V217 HydrophobicContact CD2-CG1 4.09Å; Y56-V217 HydrophobicContact CD2-CG2 4.38Å; Y56-V217 HydrophobicContact CE2-CG1 4.47Å; Y56-V217 HydrophobicContact CG-CB 4.5Å; Y56-V217 HydrophobicContact CG-CG1 4.46Å; Y56-V217 HydrophobicContact CG-CG2 3.93Å; Y56-L226 HydrophobicContact CE2-CD1 3.67Å; Y56-F293 HydrophobicContact CD1-CZ 4.34Å; Y56-F293 HydrophobicContact CE1-CZ 4.46Å; Y56-P304 PolarHBondContact OH-O 2.91Å; Y56-L305 HydrophobicContact CD1-CD2 4.25Å; Y56-L305 HydrophobicContact CE1-CD2 3.71Å; Y56-L305 HydrophobicContact CE2-CD2 4.22Å; Y56-P308 HydrophobicContact CE2-CB 4.33Å; Y56-P308 HydrophobicContact CE2-CG 4.26Å; Y56-P308 WeakPolarHBondContact OH-CG 3.39Å; Y56-L313 HydrophobicContact CD1-CD1 4.09Å; Y56-L313 HydrophobicContact CE1-CD1 3.64Å
57	M	98.1	Very high	94.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.3	-47.1	175.9	-76.6	179.7	73.8	0	0	111.4	V53 S54 E59 C60 L61 L200 V202 F293 L313	V53-M57 HydrophobicContact CG1-CG 4.23Å; V53-M57 HydrophobicContact CG1-SD 4.15Å; V53-M57 WeakPolarHBondContact O-CB 3.46Å; V53-M57 WeakPolarHBondContact O-CG 3.3Å; V53-M57 PolarHBondContact O-N 3.32Å; S54-M57 PolarHBondContact O-N 3.04Å; M57-E59 VanDerWaalsContact C-N 3.33Å; M57-E59 PolarHBondContact O-N 3.05Å; M57-C60 PolarHBondContact O-N 3.49Å; M57-L61 HydrophobicContact CE-CD1 4.32Å; M57-L61 WeakPolarHBondContact O-CB 3.45Å; M57-L61 WeakPolarHBondContact O-CG 3.34Å; M57-L61 PolarHBondContact O-N 3.34Å; M57-L200 WeakPolarHBondContact CE-O 3.42Å; M57-V202 HydrophobicContact SD-CB 4.38Å; M57-V202 HydrophobicContact SD-CG2 3.7Å; M57-F293 HydrophobicContact CE-CD2 4.47Å; M57-F293 HydrophobicContact CE-CE2 4.13Å; M57-F293 HydrophobicContact CG-CD2 4.43Å; M57-F293 HydrophobicContact CG-CE2 3.48Å; M57-F293 VanDerWaalsContact CG-CE2 3.48Å; M57-F293 HydrophobicContact CG-CZ 3.82Å; M57-F293 HydrophobicContact SD-CD2 3.97Å; M57-F293 HydrophobicContact SD-CE2 3.58Å; M57-F293 VanDerWaalsContact SD-CE2 3.58Å; M57-F293 HydrophobicContact SD-CZ 4.39Å; M57-L313 HydrophobicContact CG-CD1 4.4Å
58	K	96.5	Very high	94.6	Very high	122 Å²	122	41.6 Å²	41.6	53%	0.53	22%	0.222	S	C	.	.	H	α-helix	trans	-57.4	-46.1	179.8	-174.5	176.7	179.8	173.6	0	111.8	S54 E55 Y56 S62 N63 P201	S54-K58 WeakPolarHBondContact O-CB 3.4Å; S54-K58 PolarHBondContact O-N 3.04Å; E55-K58 PolarHBondContact O-N 2.89Å; Y56-K58 VanDerWaalsContact C-N 3.35Å; Y56-K58 PolarHBondContact O-N 3.33Å; K58-S62 WeakPolarHBondContact CG-OG 3.41Å; K58-S62 WeakPolarHBondContact O-CA 3.29Å; K58-S62 PolarHBondContact O-N 3.21Å; K58-S62 PolarHBondContact O-OG 3.43Å; K58-N63 PolarHBondContact O-N 3.47Å; K58-P201 HydrophobicContact CB-CG 3.89Å; K58-P201 HydrophobicContact CG-CG 4.46Å
59	E	96.4	Very high	94	Very high	51 Å²	51	35.6 Å²	35.6	24%	0.238	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-43.4	177.2	-68.1	-61.8	159.7	0	0	111.7	L41 R44 E55 Y56 M57 L61 N63	L41-E59 HydrophobicContact CD2-CB 4.09Å; L41-E59 HydrophobicContact CD2-CG 4.14Å; R44-E59 IonicContact NH1-OE1 2.81Å; E55-E59 WeakPolarHBondContact O-CG 3.43Å; E55-E59 PolarHBondContact O-N 2.81Å; Y56-E59 PolarHBondContact O-N 3.2Å; M57-E59 VanDerWaalsContact C-N 3.33Å; M57-E59 PolarHBondContact O-N 3.05Å; E59-L61 PolarHBondContact O-N 3.03Å; E59-N63 WeakPolarHBondContact O-CB 3.32Å; E59-N63 PolarHBondContact O-N 3.07Å; E59-N63 PolarHBondContact OE2-ND2 3.24Å
60	C	96.2	Very high	93.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69	-34.1	-179	-66.5	0	0	0	0	113.4	Y56 M57 G67 Y68 G309 L313	Y56-C60 VanDerWaalsContact CE2-SG 3.57Å; Y56-C60 WeakPolarHBondContact O-CB 3.35Å; Y56-C60 PolarHBondContact O-N 2.59Å; Y56-C60 PolarHBondContact O-SG 3.06Å; M57-C60 PolarHBondContact O-N 3.49Å; C60-G67 CarbonylContact O-C 3.56Å; C60-G67 WeakPolarHBondContact O-CA 3.3Å; C60-Y68 PolarHBondContact O-N 3.16Å; C60-G309 WeakPolarHBondContact O-CA 3.21Å; C60-L313 HydrophobicContact CB-CD1 3.41Å; C60-L313 VanDerWaalsContact CB-CD1 3.41Å; C60-L313 HydrophobicContact CB-CG 4.29Å
61	L	93.6	Very high	92.6	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-95.1	-44.9	-173.5	-65.8	176.7	0	0	0	112.5	M57 E59 G67 Y68 Y69 V199 L313	M57-L61 HydrophobicContact CE-CD1 4.32Å; M57-L61 WeakPolarHBondContact O-CB 3.45Å; M57-L61 WeakPolarHBondContact O-CG 3.34Å; M57-L61 PolarHBondContact O-N 3.34Å; E59-L61 PolarHBondContact O-N 3.03Å; L61-G67 CarbonylContact O-C 3.5Å; L61-Y68 HydrophobicContact CD2-CD1 4.49Å; L61-Y68 PolarHBondContact O-N 3.31Å; L61-Y69 HydrophobicContact CB-CD2 4.01Å; L61-Y69 HydrophobicContact CB-CE2 3.97Å; L61-Y69 HydrophobicContact CD1-CE2 4.46Å; L61-Y69 HydrophobicContact CD2-CD2 4.42Å; L61-Y69 HydrophobicContact CD2-CE2 3.81Å; L61-Y69 HydrophobicContact CG-CE2 4.3Å; L61-Y69 WeakPolarHBondContact O-CD2 3.48Å; L61-Y69 PolarHBondContact O-N 3.16Å; L61-Y69 VanDerWaalsContact O-N 3.11Å; L61-V199 HydrophobicContact CD1-CB 4.23Å; L61-V199 WeakPolarHBondContact CD1-O 3.31Å; L61-L313 HydrophobicContact CD1-CB 4.18Å; L61-L313 WeakPolarHBondContact CD1-O 3.42Å; L61-L313 HydrophobicContact CD2-CB 3.94Å; L61-L313 HydrophobicContact CD2-CG 4.39Å; L61-L313 HydrophobicContact CG-CB 4.15Å
62	S	90.3	Very high	91.2	Very high	40 Å²	40	36.7 Å²	36.7	28%	0.28	19%	0.192	S	C	.	.	H	α-helix	trans	-115.6	-0.7	-164.6	72.9	0	0	0	0	114.8	K58 N70	K58-S62 WeakPolarHBondContact CG-OG 3.41Å; K58-S62 WeakPolarHBondContact O-CA 3.29Å; K58-S62 PolarHBondContact O-N 3.21Å; K58-S62 PolarHBondContact O-OG 3.43Å; S62-N70 PolarHBondContact O-ND2 3.48Å; S62-N70 VanDerWaalsContact O-ND2 3.1Å
63	N	91.4	Very high	89.5	Confident	21 Å²	21	39.7 Å²	39.7	11%	0.112	21%	0.214	C	C	.	.			trans	-55.7	129.8	176.2	-179.6	-64.3	0	0	0	110.2	K58 E59 L65 Y66 G67 N70	K58-N63 PolarHBondContact O-N 3.47Å; E59-N63 WeakPolarHBondContact O-CB 3.32Å; E59-N63 PolarHBondContact O-N 3.07Å; E59-N63 PolarHBondContact OE2-ND2 3.24Å; N63-L65 PolarHBondContact O-N 3.11Å; N63-L65 PolarHBondContact OD1-N 3.37Å; N63-Y66 WeakPolarHBondContact OD1-CD2 3.46Å; N63-Y66 PolarHBondContact OD1-N 3.48Å; N63-G67 VanDerWaalsContact O-CA 3.26Å; N63-G67 WeakPolarHBondContact O-CA 3.47Å; N63-G67 PolarHBondContact O-N 2.84Å; N63-N70 PolarHBondContact O-ND2 3.06Å
64	P	87.8	Confident	87.5	Confident	107 Å²	107	40 Å²	40	70%	0.695	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.9	-175.1	-26.9	35.5	0	0	0	115.3
65	L	88.7	Confident	85.2	Confident	116 Å²	116	41.7 Å²	41.7	61%	0.607	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-35.5	-175.4	-62.1	179.2	0	0	0	112.9	N63 T71	N63-L65 PolarHBondContact O-N 3.11Å; N63-L65 PolarHBondContact OD1-N 3.37Å; L65-T71 WeakPolarHBondContact O-CG2 3.26Å
66	Y	90.2	Very high	82.8	Confident	40 Å²	40	40.2 Å²	40.2	16%	0.157	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-6.9	-170.5	-46.6	-70.1	0	0	0	113.8	L33 T36 L37 Q40 N63 G309	L33-Y66 HydrophobicContact CB-CD1 4.4Å; L33-Y66 HydrophobicContact CD2-CD1 3.97Å; L33-Y66 HydrophobicContact CD2-CE1 4.2Å; T36-Y66 HydrophobicContact CG2-CE1 3.77Å; L37-Y66 HydrophobicContact CB-CG 4.13Å; L37-Y66 HydrophobicContact CD1-CD2 4.15Å; L37-Y66 HydrophobicContact CD1-CG 4.44Å; Q40-Y66 PolarHBondContact NE2-OH 3.14Å; Q40-Y66 VanDerWaalsContact NE2-OH 3.16Å; N63-Y66 WeakPolarHBondContact OD1-CD2 3.46Å; N63-Y66 PolarHBondContact OD1-N 3.48Å; Y66-G309 WeakPolarHBondContact O-CA 3.21Å
67	G	89.6	Confident	80.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.272	C	S	.	.			trans	-71.3	144.1	-175.1	0	0	0	0	0	111.9	C60 L61 N63 Y69 N70 T71	C60-G67 CarbonylContact O-C 3.56Å; C60-G67 WeakPolarHBondContact O-CA 3.3Å; L61-G67 CarbonylContact O-C 3.5Å; N63-G67 VanDerWaalsContact O-CA 3.26Å; N63-G67 WeakPolarHBondContact O-CA 3.47Å; N63-G67 PolarHBondContact O-N 2.84Å; G67-Y69 PolarHBondContact O-N 3.05Å; G67-N70 PolarHBondContact O-N 3.2Å; G67-T71 PolarHBondContact O-N 3.27Å; G67-T71 PolarHBondContact O-OG1 3Å
68	Y	88.6	Confident	77.7	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-49.5	-52	-177.9	177.2	-104.1	0	0	0	112.3	C60 L61 N70 T71 H72 V74 D80 G309 D312	C60-Y68 PolarHBondContact O-N 3.16Å; L61-Y68 HydrophobicContact CD2-CD1 4.49Å; L61-Y68 PolarHBondContact O-N 3.31Å; Y68-N70 VanDerWaalsContact C-N 3.25Å; Y68-N70 PolarHBondContact O-N 3.06Å; Y68-T71 PolarHBondContact O-N 2.52Å; Y68-H72 HydrophobicContact CD2-CB 4.16Å; Y68-H72 AromaticContact CD2-CG 3.72Å; Y68-H72 AromaticContact CD2-ND1 3.86Å; Y68-H72 HydrophobicContact CE2-CB 4.15Å; Y68-H72 AromaticContact CE2-CG 3.95Å; Y68-H72 VanDerWaalsContact O-CB 3.27Å; Y68-H72 WeakPolarHBondContact O-CB 3.46Å; Y68-H72 PolarHBondContact O-N 2.91Å; Y68-H72 PolarHBondContact O-ND1 2.87Å; Y68-V74 HydrophobicContact CD1-CG2 4.08Å; Y68-V74 HydrophobicContact CE1-CB 4.26Å; Y68-V74 HydrophobicContact CE1-CG1 3.69Å; Y68-V74 HydrophobicContact CE1-CG2 3.67Å; Y68-D80 PolarHBondContact OH-OD2 3.27Å; Y68-G309 WeakPolarHBondContact CA-O 3.43Å; Y68-G309 PolarHBondContact N-O 2.9Å; Y68-D312 HydrophobicContact CD1-CB 4.24Å; Y68-D312 HydrophobicContact CE1-CB 3.65Å; Y68-D312 WeakPolarHBondContact CE1-OD2 3.47Å; Y68-D312 HydrophobicContact CE2-CB 4.21Å
69	Y	84.9	Confident	75.7	Confident	43 Å²	43	49.9 Å²	49.9	17%	0.169	28%	0.279	C	S	.	.	H	α-helix	trans	-72.1	-11.5	-177.5	-63.3	-67.1	0	0	0	115.3	L61 G67 V74 S150 V199 D312	L61-Y69 HydrophobicContact CB-CD2 4.01Å; L61-Y69 HydrophobicContact CB-CE2 3.97Å; L61-Y69 HydrophobicContact CD1-CE2 4.46Å; L61-Y69 HydrophobicContact CD2-CD2 4.42Å; L61-Y69 HydrophobicContact CD2-CE2 3.81Å; L61-Y69 HydrophobicContact CG-CE2 4.3Å; L61-Y69 WeakPolarHBondContact O-CD2 3.48Å; L61-Y69 PolarHBondContact O-N 3.16Å; L61-Y69 VanDerWaalsContact O-N 3.11Å; G67-Y69 PolarHBondContact O-N 3.05Å; Y69-V74 HydrophobicContact CD1-CG1 4.27Å; Y69-V74 HydrophobicContact CD1-CG2 3.78Å; Y69-V74 HydrophobicContact CE1-CG1 3.99Å; Y69-V74 HydrophobicContact CE1-CG2 4.27Å; Y69-S150 WeakPolarHBondContact O-CB 3.29Å; Y69-S150 PolarHBondContact O-OG 3.19Å; Y69-V199 HydrophobicContact CE2-CB 4.31Å; Y69-V199 HydrophobicContact CE2-CG1 4.49Å; Y69-V199 WeakPolarHBondContact OH-CG1 3.45Å; Y69-D312 PolarHBondContact OH-OD1 2.97Å
70	N	82.9	Confident	73.8	Confident	52 Å²	52	47.8 Å²	47.8	28%	0.278	27%	0.269	S	S	.	.	H	α-helix	trans	-102	-23	177.6	-68.3	-49.2	0	0	0	112.9	S62 N63 G67 Y68	S62-N70 PolarHBondContact O-ND2 3.48Å; S62-N70 VanDerWaalsContact O-ND2 3.1Å; N63-N70 PolarHBondContact O-ND2 3.06Å; G67-N70 PolarHBondContact O-N 3.2Å; Y68-N70 VanDerWaalsContact C-N 3.25Å; Y68-N70 PolarHBondContact O-N 3.06Å
71	T	80.1	Confident	72.1	Confident	39 Å²	39	50 Å²	50	24%	0.239	28%	0.279	C	S	.	.	H	α-helix	trans	-111.7	-18.5	-174.4	58.9	0	0	0	0	114	L33 L65 G67 Y68	L33-T71 HydrophobicContact CD1-CG2 4.11Å; L65-T71 WeakPolarHBondContact O-CG2 3.26Å; G67-T71 PolarHBondContact O-N 3.27Å; G67-T71 PolarHBondContact O-OG1 3Å; Y68-T71 PolarHBondContact O-N 2.52Å
72	H	69	Low	71.1	Confident	22 Å²	22	53.7 Å²	53.7	10%	0.102	30%	0.302	C	S	.	.	S	Bend	trans	-104.4	144.8	-177.6	-65.9	62.5	0	0	0	112.2	Q30 Y68 V74 G309 H310	Q30-H72 PolarHBondContact NE2-CD2 3.44Å; Y68-H72 HydrophobicContact CD2-CB 4.16Å; Y68-H72 AromaticContact CD2-CG 3.72Å; Y68-H72 AromaticContact CD2-ND1 3.86Å; Y68-H72 HydrophobicContact CE2-CB 4.15Å; Y68-H72 AromaticContact CE2-CG 3.95Å; Y68-H72 VanDerWaalsContact O-CB 3.27Å; Y68-H72 WeakPolarHBondContact O-CB 3.46Å; Y68-H72 PolarHBondContact O-N 2.91Å; Y68-H72 PolarHBondContact O-ND1 2.87Å; H72-V74 HydrophobicContact CB-CG2 4.1Å; H72-V74 PolarHBondContact O-N 3.35Å; H72-G309 PolarHBondContact CE1-O 3.26Å; H72-H310 AromaticContact CE1-CD2 3.71Å; H72-H310 AromaticContact NE2-CD2 2.98Å; H72-H310 PolarHBondContact NE2-CD2 2.89Å; H72-H310 AromaticContact NE2-CG 3.85Å; H72-H310 AromaticContact NE2-NE2 3.6Å
73	S	62.2	Low	70.6	Confident	85 Å²	85	52.9 Å²	52.9	59%	0.594	30%	0.295	S	S	*	.			trans	-75.4	84.4	155.9	59	0	0	0	0	107.9	F75	S73-F75 PolarHBondContact O-N 2.98Å
74	V	56.6	Low	70.2	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.036	29%	0.29	C	S	.	.			trans	-57.8	-23	-173.4	178.7	0	0	0	0	113.2	Y68 Y69 H72 G79	Y68-V74 HydrophobicContact CD1-CG2 4.08Å; Y68-V74 HydrophobicContact CE1-CB 4.26Å; Y68-V74 HydrophobicContact CE1-CG1 3.69Å; Y68-V74 HydrophobicContact CE1-CG2 3.67Å; Y69-V74 HydrophobicContact CD1-CG1 4.27Å; Y69-V74 HydrophobicContact CD1-CG2 3.78Å; Y69-V74 HydrophobicContact CE1-CG1 3.99Å; Y69-V74 HydrophobicContact CE1-CG2 4.27Å; H72-V74 HydrophobicContact CB-CG2 4.1Å; H72-V74 PolarHBondContact O-N 3.35Å; V74-G79 WeakPolarHBondContact O-CA 3.47Å
75	F	50.5	Low	69.8	Low	55 Å²	55	47.2 Å²	47.2	24%	0.241	26%	0.26	C	S	.	.	S	Bend	trans	-127.8	135.4	-172.2	-53.9	-80.4	0	0	0	114.4	S73 R121 M153	S73-F75 PolarHBondContact O-N 2.98Å; F75-R121 HydrophobicContact CB-CG 3.8Å; F75-R121 HydrophobicContact CD1-CG 4.45Å; F75-R121 HydrophobicContact CD2-CG 4.12Å; F75-R121 HydrophobicContact CG-CG 3.87Å; F75-M153 HydrophobicContact CD2-CE 3.54Å; F75-M153 HydrophobicContact CD2-SD 3.86Å; F75-M153 HydrophobicContact CE2-CE 3.51Å; F75-M153 HydrophobicContact CE2-SD 3.99Å
76	G	47.2	Very low	69.5	Low	38 Å²	38	45.3 Å²	45.3	39%	0.392	25%	0.247	S	C	.	.	S	Bend	trans	148.8	-174.2	178.9	0	0	0	0	0	112.1	S78 G79	G76-S78 PolarHBondContact O-N 2.98Å; G76-G79 PolarHBondContact O-N 3.24Å
77	K	43.3	Very low	69.2	Low	229 Å²	229	45.1 Å²	45.1	100%	0.996	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.7	172.7	-74.1	-171.6	177	-175	0	113.5
78	S	46.6	Very low	69.1	Low	93 Å²	93	45.4 Å²	45.4	65%	0.65	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	4.7	176.3	56.4	0	0	0	0	113.8	G76	G76-S78 PolarHBondContact O-N 2.98Å
79	G	54	Low	69.2	Low	3 Å²	3	49.5 Å²	49.5	3%	0.031	27%	0.27	C	S	.	.	S	Bend	trans	-76.3	157.7	176.4	0	0	0	0	0	111.3	V74 G76 F81 H299	V74-G79 WeakPolarHBondContact O-CA 3.47Å; G76-G79 PolarHBondContact O-N 3.24Å; G79-F81 VanDerWaalsContact C-N 3.33Å; G79-H299 PolarHBondContact O-CE1 2.97Å; G79-H299 PolarHBondContact O-NE2 3.38Å
80	D	56.9	Low	69.7	Low	7 Å²	7	47.4 Å²	47.4	4%	0.037	26%	0.262	C	S	.	.	S	Bend	trans	-80.8	-15.7	-174.7	-69.7	-22.1	0	0	0	113.1	Y68 H297 K298 H299	Y68-D80 PolarHBondContact OH-OD2 3.27Å; D80-H297 IonicContact OD2-ND1 2.59Å; D80-K298 WeakPolarHBondContact OD1-CA 3.36Å; D80-K298 PolarHBondContact OD1-N 3.19Å; D80-H299 PolarHBondContact O-CD2 3.06Å; D80-H299 PolarHBondContact O-N 3.44Å
81	F	58.8	Low	70.4	Confident	47 Å²	47	45 Å²	45	21%	0.206	25%	0.248	C	C	.	.			trans	-141.3	151.2	-177.5	-67.5	-78.9	0	0	0	115	G79 F296 D312	G79-F81 VanDerWaalsContact C-N 3.33Å; F81-F296 HydrophobicContact CE1-CB 4.11Å; F81-F296 AromaticContact CE1-CD1 3.71Å; F81-F296 HydrophobicContact CE1-CD1 3.71Å; F81-F296 AromaticContact CE1-CD2 3.99Å; F81-F296 HydrophobicContact CE1-CD2 3.99Å; F81-F296 AromaticContact CE1-CE1 4Å; F81-F296 HydrophobicContact CE1-CE1 4Å; F81-F296 HydrophobicContact CE1-CE2 4.21Å; F81-F296 AromaticContact CE1-CG 3.69Å; F81-F296 HydrophobicContact CE1-CG 3.69Å; F81-F296 HydrophobicContact CE1-CZ 4.22Å; F81-F296 HydrophobicContact CE2-CB 3.61Å; F81-F296 HydrophobicContact CE2-CD2 4.27Å; F81-F296 HydrophobicContact CE2-CG 4.01Å; F81-F296 HydrophobicContact CZ-CB 3.28Å; F81-F296 AromaticContact CZ-CD1 3.69Å; F81-F296 HydrophobicContact CZ-CD1 3.69Å; F81-F296 AromaticContact CZ-CD2 3.31Å; F81-F296 HydrophobicContact CZ-CD2 3.31Å; F81-F296 HydrophobicContact CZ-CE1 4.26Å; F81-F296 AromaticContact CZ-CE2 3.88Å; F81-F296 HydrophobicContact CZ-CE2 3.88Å; F81-F296 AromaticContact CZ-CG 3.15Å; F81-F296 HydrophobicContact CZ-CG 3.15Å; F81-F296 HydrophobicContact CZ-CZ 4.33Å; F81-D312 HydrophobicContact CD2-CB 4.5Å; F81-D312 WeakPolarHBondContact CD2-OD2 3.16Å; F81-D312 HydrophobicContact CE2-CB 3.78Å; F81-D312 WeakPolarHBondContact CE2-OD2 3.29Å
82	T	72.9	Confident	71.2	Confident	81 Å²	81	43.1 Å²	43.1	50%	0.497	24%	0.237	S	C	.	.			trans	-114.6	122.3	163.7	-49.6	0	0	0	0	108	E86 I87	T82-E86 HydrophobicContact CG2-CB 3.91Å; T82-I87 HydrophobicContact CG2-CD1 4.36Å; T82-I87 HydrophobicContact CG2-CG1 3.55Å
83	T	80.4	Confident	72.6	Confident	23 Å²	23	43.3 Å²	43.3	14%	0.141	24%	0.238	C	C	.	.			trans	-94.8	162.4	-176.8	60.8	0	0	0	0	111.6	P85 E86 I87 E195	T83-P85 VanDerWaalsContact C-CD 3.5Å; T83-E86 WeakPolarHBondContact O-CA 3.31Å; T83-E86 WeakPolarHBondContact O-CB 3.42Å; T83-E86 PolarHBondContact O-N 2.84Å; T83-E86 WeakPolarHBondContact OG1-CG 3.36Å; T83-I87 WeakPolarHBondContact O-CG1 3.39Å; T83-I87 PolarHBondContact O-N 3.04Å; T83-E195 VanDerWaalsContact CB-OE1 3.23Å; T83-E195 WeakPolarHBondContact CB-OE1 3.31Å; T83-E195 VanDerWaalsContact CG2-OE1 3.23Å; T83-E195 WeakPolarHBondContact CG2-OE1 3.3Å
84	S	82.9	Confident	74.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-50.3	-45	-178.2	-64.2	0	0	0	0	114.5	E86 I87 C88 Q341 M383	S84-E86 VanDerWaalsContact C-N 3.26Å; S84-E86 PolarHBondContact O-N 2.89Å; S84-I87 PolarHBondContact O-N 3.37Å; S84-C88 PolarHBondContact O-N 2.75Å; S84-Q341 PolarHBondContact OG-NE2 3.47Å; S84-Q341 PolarHBondContact OG-OE1 2.9Å; S84-M383 WeakPolarHBondContact OG-CE 3.3Å
85	P	79.2	Confident	76.3	Confident	10 Å²	10	39.4 Å²	39.4	7%	0.065	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-27.9	175.9	-21.2	32.6	0	0	0	114.2	T83 F91 T123 L124 H194	T83-P85 VanDerWaalsContact C-CD 3.5Å; P85-F91 HydrophobicContact CB-CD1 4.43Å; P85-F91 HydrophobicContact CG-CD1 3.82Å; P85-F91 HydrophobicContact CG-CE1 3.92Å; P85-T123 HydrophobicContact CB-CG2 4.14Å; P85-L124 HydrophobicContact CB-CB 4.14Å; P85-L124 HydrophobicContact CG-CB 3.92Å; P85-L124 HydrophobicContact CG-CD1 4.43Å; P85-H194 VanDerWaalsContact CD-CE1 3.45Å; P85-H194 WeakPolarHBondContact CD-CE1 3.19Å
86	E	83.3	Confident	78.5	Confident	75 Å²	75	36.8 Å²	36.8	35%	0.35	20%	0.199	S	C	.	.	H	α-helix	trans	-81.9	-24	178	-59.4	-69.3	153	0	0	112	T82 T83 S84 R121 T123	T82-E86 HydrophobicContact CG2-CB 3.91Å; T83-E86 WeakPolarHBondContact O-CA 3.31Å; T83-E86 WeakPolarHBondContact O-CB 3.42Å; T83-E86 PolarHBondContact O-N 2.84Å; T83-E86 WeakPolarHBondContact OG1-CG 3.36Å; S84-E86 VanDerWaalsContact C-N 3.26Å; S84-E86 PolarHBondContact O-N 2.89Å; E86-R121 WeakPolarHBondContact OE1-CD 3.42Å; E86-T123 WeakPolarHBondContact OE1-CB 3.27Å; E86-T123 PolarHBondContact OE1-OG1 3.02Å
87	I	82.4	Confident	81	Confident	37 Å²	37	37.6 Å²	37.6	19%	0.19	20%	0.196	C	C	.	.	H	α-helix	trans	-77.1	-49.6	178.9	-66.3	164.9	0	0	0	110.7	T82 T83 S84 A373 I376 L377 M383	T82-I87 HydrophobicContact CG2-CD1 4.36Å; T82-I87 HydrophobicContact CG2-CG1 3.55Å; T83-I87 WeakPolarHBondContact O-CG1 3.39Å; T83-I87 PolarHBondContact O-N 3.04Å; S84-I87 PolarHBondContact O-N 3.37Å; I87-A373 HydrophobicContact CG2-CB 4Å; I87-A373 WeakPolarHBondContact CG2-O 3.43Å; I87-A373 WeakPolarHBondContact O-CB 3.4Å; I87-I376 HydrophobicContact CD1-CG2 3.84Å; I87-I376 HydrophobicContact CG2-CB 4.21Å; I87-I376 HydrophobicContact CG2-CD1 4.38Å; I87-I376 HydrophobicContact CG2-CG2 4.25Å; I87-L377 HydrophobicContact CB-CD2 4.38Å; I87-L377 HydrophobicContact CD1-CD2 4.49Å; I87-L377 HydrophobicContact CG2-CD2 4.35Å; I87-M383 HydrophobicContact CD1-CE 4.29Å; I87-M383 HydrophobicContact CD1-SD 3.39Å; I87-M383 WeakPolarHBondContact CD1-SD 3.22Å
88	C	88.4	Confident	83.6	Confident	5 Å²	5	26.8 Å²	26.8	3%	0.034	15%	0.149	C	C	.	.			trans	-148.3	125.9	-174	-170.3	0	0	0	0	112.8	S84 I90 F91 A373 L377	S84-C88 PolarHBondContact O-N 2.75Å; C88-I90 PolarHBondContact O-N 3.26Å; C88-F91 WeakPolarHBondContact O-CB 3.47Å; C88-F91 PolarHBondContact O-N 3.31Å; C88-A373 HydrophobicContact CB-CB 4Å; C88-L377 HydrophobicContact CB-CD1 3.67Å; C88-L377 HydrophobicContact CB-CG 4.42Å
89	Q	91.2	Very high	86.1	Confident	89 Å²	89	22.4 Å²	22.4	42%	0.416	12%	0.118	S	C	.	.	H	α-helix	trans	-56	-27.4	177.2	68.8	-178.6	-17.5	0	0	113.9	F91 G92 E93 L357	Q89-F91 PolarHBondContact O-N 3.41Å; Q89-G92 PolarHBondContact O-N 3.33Å; Q89-E93 VanDerWaalsContact O-CG 3.29Å; Q89-E93 WeakPolarHBondContact O-CG 3.33Å; Q89-E93 PolarHBondContact O-N 2.92Å; Q89-L357 HydrophobicContact CG-CD1 4.26Å
90	I	95.4	Very high	88.2	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-33.2	179.8	-61.9	-174.9	0	0	0	110.6	C88 E93 L94 L350 R353 L354 L357	C88-I90 PolarHBondContact O-N 3.26Å; I90-E93 PolarHBondContact O-N 2.97Å; I90-L94 HydrophobicContact CG2-CD1 3.78Å; I90-L94 HydrophobicContact CG2-CG 3.95Å; I90-L94 WeakPolarHBondContact O-CB 3.33Å; I90-L94 VanDerWaalsContact O-CG 3.28Å; I90-L94 WeakPolarHBondContact O-CG 3.47Å; I90-L94 PolarHBondContact O-N 3.05Å; I90-L350 HydrophobicContact CG2-CD1 4.43Å; I90-L350 HydrophobicContact CG2-CG 4.21Å; I90-R353 HydrophobicContact CD1-CG 4.18Å; I90-R353 HydrophobicContact CG1-CG 4.04Å; I90-R353 HydrophobicContact CG2-CB 4.23Å; I90-R353 HydrophobicContact CG2-CG 4.01Å; I90-L354 HydrophobicContact CD1-CB 3.87Å; I90-L354 HydrophobicContact CD1-CD1 4.15Å; I90-L357 HydrophobicContact CD1-CD1 3.73Å; I90-L357 HydrophobicContact CG1-CD1 3.48Å; I90-L357 VanDerWaalsContact CG1-CD1 3.48Å
91	F	97.1	Very high	90	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-55.5	-62.7	177.3	-175.8	-90.1	0	0	0	110.7	P85 C88 Q89 E93 L94 I95 L124 H194 I281 Q341 L345 L377 F389	P85-F91 HydrophobicContact CB-CD1 4.43Å; P85-F91 HydrophobicContact CG-CD1 3.82Å; P85-F91 HydrophobicContact CG-CE1 3.92Å; C88-F91 WeakPolarHBondContact O-CB 3.47Å; C88-F91 PolarHBondContact O-N 3.31Å; Q89-F91 PolarHBondContact O-N 3.41Å; F91-E93 VanDerWaalsContact C-N 3.26Å; F91-E93 PolarHBondContact O-N 3.23Å; F91-L94 PolarHBondContact O-N 3.41Å; F91-L94 VanDerWaalsContact O-N 3.16Å; F91-I95 HydrophobicContact CD1-CG1 4.24Å; F91-I95 HydrophobicContact CE1-CD1 4.44Å; F91-I95 HydrophobicContact CE1-CG1 4Å; F91-I95 HydrophobicContact CZ-CD1 4.45Å; F91-I95 HydrophobicContact CZ-CG1 4.49Å; F91-I95 WeakPolarHBondContact O-CG1 2.8Å; F91-I95 PolarHBondContact O-N 2.85Å; F91-I95 VanDerWaalsContact O-N 3.1Å; F91-L124 HydrophobicContact CD1-CD1 4.33Å; F91-L124 HydrophobicContact CE1-CD1 4.34Å; F91-H194 AromaticContact CE1-CD2 3.7Å; F91-H194 AromaticContact CE1-NE2 3.74Å; F91-H194 AromaticContact CZ-CD2 3.46Å; F91-H194 VanDerWaalsContact CZ-CD2 3.46Å; F91-H194 WeakPolarHBondContact CZ-CD2 3.09Å; F91-H194 AromaticContact CZ-NE2 3.44Å; F91-H194 WeakPolarHBondContact CZ-NE2 3.27Å; F91-I281 HydrophobicContact CZ-CD1 4.03Å; F91-I281 HydrophobicContact CZ-CG2 4.48Å; F91-Q341 HydrophobicContact CE2-CG 4.49Å; F91-L345 HydrophobicContact CD2-CD1 4.03Å; F91-L345 HydrophobicContact CD2-CD2 3.93Å; F91-L345 HydrophobicContact CE2-CD1 4.49Å; F91-L345 HydrophobicContact CE2-CD2 4.33Å; F91-L377 HydrophobicContact CB-CD1 3.95Å; F91-L377 HydrophobicContact CD2-CD1 4.34Å; F91-F389 HydrophobicContact CE2-CE2 4.4Å; F91-F389 AromaticContact CE2-CZ 3.7Å; F91-F389 HydrophobicContact CE2-CZ 3.7Å; F91-F389 AromaticContact CZ-CZ 3.88Å; F91-F389 HydrophobicContact CZ-CZ 3.88Å
92	G	97.1	Very high	91.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.7	-30.8	-178	0	0	0	0	0	113.2	Q89 I95 G96	Q89-G92 PolarHBondContact O-N 3.33Å; G92-I95 PolarHBondContact O-N 3.12Å; G92-G96 PolarHBondContact O-N 3.43Å
93	E	97.5	Very high	93	Very high	27 Å²	27	20.2 Å²	20.2	13%	0.126	10%	0.102	C	C	.	.	H	α-helix	trans	-62.5	-45.5	173.4	-72.6	177.7	157.3	0	0	112.4	Q89 I90 F91 G96 V97 V131 R353	Q89-E93 VanDerWaalsContact O-CG 3.29Å; Q89-E93 WeakPolarHBondContact O-CG 3.33Å; Q89-E93 PolarHBondContact O-N 2.92Å; I90-E93 PolarHBondContact O-N 2.97Å; F91-E93 VanDerWaalsContact C-N 3.26Å; F91-E93 PolarHBondContact O-N 3.23Å; E93-G96 PolarHBondContact O-N 3.43Å; E93-V97 WeakPolarHBondContact O-CG2 3.49Å; E93-V97 PolarHBondContact O-N 2.98Å; E93-V131 HydrophobicContact CB-CG2 4.12Å; E93-V131 HydrophobicContact CG-CG2 4.13Å; E93-R353 VanDerWaalsContact CD-NH2 3.29Å; E93-R353 IonicContact OE1-CZ 3.55Å; E93-R353 IonicContact OE1-NE 3.71Å; E93-R353 IonicContact OE1-NH2 2.67Å; E93-R353 PolarHBondContact OE1-NH2 3.04Å; E93-R353 IonicContact OE2-CZ 3.27Å; E93-R353 VanDerWaalsContact OE2-CZ 3.27Å; E93-R353 IonicContact OE2-NE 2.64Å; E93-R353 PolarHBondContact OE2-NE 3.44Å; E93-R353 IonicContact OE2-NH2 3.17Å; E93-R353 PolarHBondContact OE2-NH2 3.3Å
94	L	98.1	Very high	93.7	Very high	9 Å²	9	23.1 Å²	23.1	5%	0.047	11%	0.112	C	C	.	.	H	α-helix	trans	-68.8	-35.6	179	-68.2	-179.2	0	0	0	112	I90 F91 G96 V97 W98 L345 M348 L350	I90-L94 HydrophobicContact CG2-CD1 3.78Å; I90-L94 HydrophobicContact CG2-CG 3.95Å; I90-L94 WeakPolarHBondContact O-CB 3.33Å; I90-L94 VanDerWaalsContact O-CG 3.28Å; I90-L94 WeakPolarHBondContact O-CG 3.47Å; I90-L94 PolarHBondContact O-N 3.05Å; F91-L94 PolarHBondContact O-N 3.41Å; F91-L94 VanDerWaalsContact O-N 3.16Å; L94-G96 VanDerWaalsContact C-N 3.34Å; L94-V97 PolarHBondContact O-N 3.12Å; L94-W98 PolarHBondContact O-N 3.41Å; L94-L345 HydrophobicContact CB-CD2 4.43Å; L94-L345 HydrophobicContact CD1-CB 4.29Å; L94-L345 HydrophobicContact CD1-CD2 3.98Å; L94-M348 HydrophobicContact CB-CB 4.25Å; L94-M348 HydrophobicContact CD1-CB 4.11Å; L94-M348 HydrophobicContact CD2-CB 4.2Å; L94-M348 WeakPolarHBondContact CD2-O 3.2Å; L94-M348 HydrophobicContact CG-CB 4.42Å; L94-L350 HydrophobicContact CD1-CB 3.89Å
95	I	98.5	Very high	94.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-45.2	170.2	-55.7	-54.4	0	0	0	110.4	F91 G92 V97 W98 L99 L124 I128 I192 L279 I281 F344 F389	F91-I95 HydrophobicContact CD1-CG1 4.24Å; F91-I95 HydrophobicContact CE1-CD1 4.44Å; F91-I95 HydrophobicContact CE1-CG1 4Å; F91-I95 HydrophobicContact CZ-CD1 4.45Å; F91-I95 HydrophobicContact CZ-CG1 4.49Å; F91-I95 WeakPolarHBondContact O-CG1 2.8Å; F91-I95 PolarHBondContact O-N 2.85Å; F91-I95 VanDerWaalsContact O-N 3.1Å; G92-I95 PolarHBondContact O-N 3.12Å; I95-V97 VanDerWaalsContact C-N 3.31Å; I95-V97 PolarHBondContact O-N 3.28Å; I95-W98 WeakPolarHBondContact O-CB 3.2Å; I95-W98 PolarHBondContact O-N 2.86Å; I95-L99 HydrophobicContact CG2-CD1 4.41Å; I95-L99 WeakPolarHBondContact O-CG 3.14Å; I95-L99 PolarHBondContact O-N 2.96Å; I95-L124 HydrophobicContact CB-CD1 4.19Å; I95-L124 HydrophobicContact CG1-CD1 4.15Å; I95-L124 HydrophobicContact CG2-CD1 4.39Å; I95-I128 HydrophobicContact CG2-CD1 4.04Å; I95-I128 HydrophobicContact CG2-CG1 4.45Å; I95-I192 HydrophobicContact CG2-CD1 3.89Å; I95-L279 HydrophobicContact CD1-CD2 3.68Å; I95-L279 HydrophobicContact CG2-CD2 4.15Å; I95-I281 HydrophobicContact CD1-CD1 3.95Å; I95-F344 HydrophobicContact CD1-CE1 3.89Å; I95-F344 HydrophobicContact CD1-CZ 4.48Å; I95-F389 HydrophobicContact CD1-CE1 3.8Å; I95-F389 HydrophobicContact CD1-CZ 4.43Å
96	G	98.4	Very high	95	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.4	-41.2	175	0	0	0	0	0	112.8	G92 E93 L94 L99 L100 F132	G92-G96 PolarHBondContact O-N 3.43Å; E93-G96 PolarHBondContact O-N 3.43Å; L94-G96 VanDerWaalsContact C-N 3.34Å; G96-L99 PolarHBondContact O-N 3.39Å; G96-L100 PolarHBondContact O-N 3.26Å; G96-F132 VanDerWaalsContact O-CE1 3.32Å; G96-F132 WeakPolarHBondContact O-CE1 3.25Å
97	V	98.1	Very high	95.6	Very high	54 Å²	54	29.2 Å²	29.2	33%	0.327	14%	0.142	S	C	.	.	H	α-helix	trans	-66.5	-43	175.4	173.7	0	0	0	0	111.5	E93 L94 I95 L99 L100 E101 V131 M348	E93-V97 WeakPolarHBondContact O-CG2 3.49Å; E93-V97 PolarHBondContact O-N 2.98Å; L94-V97 PolarHBondContact O-N 3.12Å; I95-V97 VanDerWaalsContact C-N 3.31Å; I95-V97 PolarHBondContact O-N 3.28Å; V97-L99 VanDerWaalsContact C-N 3.33Å; V97-L99 PolarHBondContact O-N 3.17Å; V97-L100 WeakPolarHBondContact O-CB 3.39Å; V97-L100 PolarHBondContact O-N 3.08Å; V97-E101 PolarHBondContact O-N 3.16Å; V97-V131 HydrophobicContact CG2-CG1 4.21Å; V97-M348 HydrophobicContact CB-CE 4.29Å; V97-M348 HydrophobicContact CG1-CE 4.03Å
98	W	98.4	Very high	96.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-57.3	-46.4	176.3	-177.6	88.1	0	0	0	111.5	L94 I95 L100 E101 E102 L279 F344 M348 A391 L407 P408	L94-W98 PolarHBondContact O-N 3.41Å; I95-W98 WeakPolarHBondContact O-CB 3.2Å; I95-W98 PolarHBondContact O-N 2.86Å; W98-L100 VanDerWaalsContact C-N 3.35Å; W98-L100 PolarHBondContact O-N 3Å; W98-E101 PolarHBondContact O-N 2.95Å; W98-E102 HydrophobicContact CD2-CG 4.06Å; W98-E102 HydrophobicContact CE3-CG 4.1Å; W98-E102 HydrophobicContact CH2-CG 3.83Å; W98-E102 HydrophobicContact CZ2-CG 3.75Å; W98-E102 HydrophobicContact CZ3-CG 4Å; W98-E102 WeakPolarHBondContact O-CG 3.33Å; W98-E102 PolarHBondContact O-N 3.1Å; W98-L279 HydrophobicContact CD2-CD2 4.27Å; W98-L279 HydrophobicContact CE3-CB 4.4Å; W98-L279 HydrophobicContact CE3-CD2 4.01Å; W98-L279 HydrophobicContact CH2-CB 4.08Å; W98-L279 HydrophobicContact CH2-CD1 4.36Å; W98-L279 HydrophobicContact CZ2-CD1 4.3Å; W98-L279 HydrophobicContact CZ3-CB 3.86Å; W98-L279 HydrophobicContact CZ3-CD2 4.3Å; W98-L279 HydrophobicContact CZ3-CG 4.5Å; W98-F344 HydrophobicContact CB-CZ 4.26Å; W98-F344 AromaticContact CD1-CE2 3.89Å; W98-F344 AromaticContact CD1-CZ 3.74Å; W98-F344 HydrophobicContact CG-CE2 4.5Å; W98-F344 AromaticContact CG-CZ 3.97Å; W98-F344 HydrophobicContact CG-CZ 3.97Å; W98-M348 HydrophobicContact CB-CE 3.72Å; W98-M348 HydrophobicContact CB-SD 4.26Å; W98-A391 HydrophobicContact CH2-CB 4.21Å; W98-A391 HydrophobicContact CZ2-CB 3.73Å; W98-L407 HydrophobicContact CZ2-CD2 4.25Å; W98-P408 PolarHBondContact NE1-O 2.7Å
99	L	98.5	Very high	96.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-37.6	176.9	-66.7	173.4	0	0	0	113.1	I95 G96 V97 E101 E102 W103 L114 I128 F132 F190 I192	I95-L99 HydrophobicContact CG2-CD1 4.41Å; I95-L99 WeakPolarHBondContact O-CG 3.14Å; I95-L99 PolarHBondContact O-N 2.96Å; G96-L99 PolarHBondContact O-N 3.39Å; V97-L99 VanDerWaalsContact C-N 3.33Å; V97-L99 PolarHBondContact O-N 3.17Å; L99-E101 VanDerWaalsContact C-N 3.35Å; L99-E102 PolarHBondContact O-N 3.41Å; L99-W103 WeakPolarHBondContact O-CB 3.41Å; L99-W103 PolarHBondContact O-N 3.26Å; L99-L114 HydrophobicContact CD1-CD1 3.76Å; L99-I128 HydrophobicContact CD1-CD1 3.92Å; L99-I128 HydrophobicContact CD1-CG1 4.32Å; L99-I128 HydrophobicContact CD1-CG2 3.91Å; L99-F132 HydrophobicContact CB-CE1 4.05Å; L99-F132 HydrophobicContact CB-CZ 3.7Å; L99-F132 HydrophobicContact CD1-CZ 4.13Å; L99-F190 HydrophobicContact CB-CD2 4.06Å; L99-F190 HydrophobicContact CB-CE2 4.19Å; L99-F190 HydrophobicContact CD2-CB 3.67Å; L99-F190 HydrophobicContact CD2-CD1 4.37Å; L99-F190 HydrophobicContact CD2-CD2 3.62Å; L99-F190 HydrophobicContact CD2-CE2 4.33Å; L99-F190 HydrophobicContact CD2-CG 3.65Å; L99-F190 HydrophobicContact CG-CD2 4.34Å; L99-F190 VanDerWaalsContact O-CE2 3.26Å; L99-F190 WeakPolarHBondContact O-CE2 3.48Å; L99-I192 HydrophobicContact CD1-CD1 3.9Å
100	L	98.1	Very high	96.9	Very high	4 Å²	4	36 Å²	36	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-61.9	-44.1	176.1	173	66.4	0	0	0	111.2	G96 V97 W98 W103 K104 F132 F135 I138	G96-L100 PolarHBondContact O-N 3.26Å; V97-L100 WeakPolarHBondContact O-CB 3.39Å; V97-L100 PolarHBondContact O-N 3.08Å; W98-L100 VanDerWaalsContact C-N 3.35Å; W98-L100 PolarHBondContact O-N 3Å; L100-W103 HydrophobicContact CD1-CE3 4.2Å; L100-W103 PolarHBondContact O-N 3.04Å; L100-K104 WeakPolarHBondContact O-CG 3.38Å; L100-K104 PolarHBondContact O-N 3.22Å; L100-K104 VanDerWaalsContact O-N 3.11Å; L100-F132 HydrophobicContact CB-CE1 4.24Å; L100-F135 HydrophobicContact CD1-CB 4.32Å; L100-F135 HydrophobicContact CD1-CG 4.26Å; L100-F135 HydrophobicContact CD2-CD1 3.98Å; L100-F135 HydrophobicContact CD2-CD2 3.61Å; L100-F135 HydrophobicContact CD2-CE1 3.88Å; L100-F135 HydrophobicContact CD2-CE2 3.52Å; L100-F135 HydrophobicContact CD2-CG 3.85Å; L100-F135 HydrophobicContact CD2-CZ 3.65Å; L100-I138 HydrophobicContact CD1-CB 4.27Å; L100-I138 HydrophobicContact CD1-CD1 4.07Å; L100-I138 HydrophobicContact CD1-CG2 3.85Å
101	E	96.1	Very high	97	Very high	76 Å²	76	42.9 Å²	42.9	36%	0.355	21%	0.206	S	C	.	.	H	α-helix	trans	-68.5	-38.8	177.8	-66.9	-51.6	132.5	0	0	111.8	V97 W98 L99 W103 K104 R105	V97-E101 PolarHBondContact O-N 3.16Å; W98-E101 PolarHBondContact O-N 2.95Å; L99-E101 VanDerWaalsContact C-N 3.35Å; E101-W103 VanDerWaalsContact C-N 3.31Å; E101-W103 PolarHBondContact O-N 3.3Å; E101-K104 PolarHBondContact O-N 3.23Å; E101-K104 IonicContact OE1-NZ 3.4Å; E101-K104 PolarHBondContact OE1-NZ 3.29Å; E101-K104 IonicContact OE2-NZ 2.6Å; E101-R105 WeakPolarHBondContact O-CB 3.44Å; E101-R105 PolarHBondContact O-N 3.41Å
102	E	96.3	Very high	97.1	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-38.2	172.1	-78.4	-63.9	101.4	0	0	112.9	W98 L99 R105 Q106 F190 S277 T393 L407	W98-E102 HydrophobicContact CD2-CG 4.06Å; W98-E102 HydrophobicContact CE3-CG 4.1Å; W98-E102 HydrophobicContact CH2-CG 3.83Å; W98-E102 HydrophobicContact CZ2-CG 3.75Å; W98-E102 HydrophobicContact CZ3-CG 4Å; W98-E102 WeakPolarHBondContact O-CG 3.33Å; W98-E102 PolarHBondContact O-N 3.1Å; L99-E102 PolarHBondContact O-N 3.41Å; E102-R105 PolarHBondContact O-N 3.19Å; E102-R105 IonicContact OE1-CZ 2.73Å; E102-R105 IonicContact OE1-NE 2.74Å; E102-R105 PolarHBondContact OE1-NE 2.89Å; E102-R105 IonicContact OE1-NH2 3.2Å; E102-R105 PolarHBondContact OE1-NH2 3.21Å; E102-R105 IonicContact OE2-CZ 3.13Å; E102-R105 IonicContact OE2-NE 3.51Å; E102-R105 IonicContact OE2-NH2 3.02Å; E102-R105 PolarHBondContact OE2-NH2 3.29Å; E102-Q106 WeakPolarHBondContact O-CG 3.43Å; E102-Q106 PolarHBondContact O-N 3.11Å; E102-F190 HydrophobicContact CB-CE1 4.04Å; E102-F190 HydrophobicContact CB-CZ 3.89Å; E102-S277 PolarHBondContact OE2-OG 2.92Å; E102-T393 WeakPolarHBondContact OE2-CG2 3.27Å; E102-L407 WeakPolarHBondContact OE1-CD1 3.43Å
103	W	97.5	Very high	97.2	Very high	11 Å²	11	43.3 Å²	43.3	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-43.4	177.4	176.7	78.3	0	0	0	111.7	L99 L100 E101 Q106 N108 P109 E137 I138 T141 F190	L99-W103 WeakPolarHBondContact O-CB 3.41Å; L99-W103 PolarHBondContact O-N 3.26Å; L100-W103 HydrophobicContact CD1-CE3 4.2Å; L100-W103 PolarHBondContact O-N 3.04Å; E101-W103 VanDerWaalsContact C-N 3.31Å; E101-W103 PolarHBondContact O-N 3.3Å; W103-Q106 PolarHBondContact O-N 3.35Å; W103-N108 HydrophobicContact CD2-CB 4.39Å; W103-N108 HydrophobicContact CE3-CB 4.43Å; W103-N108 VanDerWaalsContact CE3-OD1 3.27Å; W103-N108 HydrophobicContact CH2-CB 3.59Å; W103-N108 WeakPolarHBondContact CH2-OD1 3.43Å; W103-N108 HydrophobicContact CZ2-CB 3.55Å; W103-N108 HydrophobicContact CZ3-CB 4.06Å; W103-N108 WeakPolarHBondContact CZ3-OD1 3.43Å; W103-N108 WeakPolarHBondContact O-CA 3.28Å; W103-N108 PolarHBondContact O-N 3.39Å; W103-P109 PolarHBondContact NE1-O 3.47Å; W103-E137 HydrophobicContact CH2-CB 3.78Å; W103-E137 HydrophobicContact CZ3-CB 4.38Å; W103-I138 HydrophobicContact CB-CD1 3.61Å; W103-I138 HydrophobicContact CB-CG1 4.45Å; W103-I138 HydrophobicContact CD2-CB 3.87Å; W103-I138 HydrophobicContact CD2-CD1 3.74Å; W103-I138 HydrophobicContact CD2-CG1 3.71Å; W103-I138 HydrophobicContact CE3-CB 3.81Å; W103-I138 HydrophobicContact CE3-CD1 4.03Å; W103-I138 HydrophobicContact CE3-CG1 4.1Å; W103-I138 HydrophobicContact CG-CD1 3.55Å; W103-I138 HydrophobicContact CG-CG1 3.87Å; W103-I138 HydrophobicContact CH2-CB 4.13Å; W103-I138 HydrophobicContact CZ2-CB 4.16Å; W103-I138 HydrophobicContact CZ3-CB 3.93Å; W103-T141 HydrophobicContact CZ2-CG2 4.37Å; W103-F190 HydrophobicContact CB-CE2 3.83Å; W103-F190 HydrophobicContact CB-CZ 3.8Å
104	K	95.9	Very high	97.3	Very high	83 Å²	83	42 Å²	42	36%	0.361	20%	0.202	S	C	.	.	H	α-helix	trans	-63.2	-45.4	174	-68.4	173.6	-171.6	164	0	111.8	L100 E101 Q106 N107 N108	L100-K104 WeakPolarHBondContact O-CG 3.38Å; L100-K104 PolarHBondContact O-N 3.22Å; L100-K104 VanDerWaalsContact O-N 3.11Å; E101-K104 PolarHBondContact O-N 3.23Å; E101-K104 IonicContact OE1-NZ 3.4Å; E101-K104 PolarHBondContact OE1-NZ 3.29Å; E101-K104 IonicContact OE2-NZ 2.6Å; K104-Q106 PolarHBondContact O-N 3.06Å; K104-N107 PolarHBondContact O-N 3.05Å; K104-N108 WeakPolarHBondContact CA-OD1 3.49Å
105	R	93.5	Very high	97.3	Very high	57 Å²	57	41.6 Å²	41.6	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-34.3	179.4	-169.9	-179.9	67.5	78.7	9	112	E101 E102 N107 L396	E101-R105 WeakPolarHBondContact O-CB 3.44Å; E101-R105 PolarHBondContact O-N 3.41Å; E102-R105 PolarHBondContact O-N 3.19Å; E102-R105 IonicContact OE1-CZ 2.73Å; E102-R105 IonicContact OE1-NE 2.74Å; E102-R105 PolarHBondContact OE1-NE 2.89Å; E102-R105 IonicContact OE1-NH2 3.2Å; E102-R105 PolarHBondContact OE1-NH2 3.21Å; E102-R105 IonicContact OE2-CZ 3.13Å; E102-R105 IonicContact OE2-NE 3.51Å; E102-R105 IonicContact OE2-NH2 3.02Å; E102-R105 PolarHBondContact OE2-NH2 3.29Å; R105-N107 VanDerWaalsContact C-N 3.26Å; R105-N107 PolarHBondContact O-N 2.78Å; R105-L396 HydrophobicContact CG-CD1 4.2Å
106	Q	95.2	Very high	97.3	Very high	16 Å²	16	42 Å²	42	8%	0.075	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	27.6	177	-61.8	-171.9	58.3	0	0	113.3	E102 W103 K104 P109 F188 G276 S277 P394 L396	E102-Q106 WeakPolarHBondContact O-CG 3.43Å; E102-Q106 PolarHBondContact O-N 3.11Å; W103-Q106 PolarHBondContact O-N 3.35Å; K104-Q106 PolarHBondContact O-N 3.06Å; Q106-P109 WeakPolarHBondContact O-CD 3.46Å; Q106-P109 WeakPolarHBondContact O-CG 3.45Å; Q106-F188 HydrophobicContact CB-CE2 3.87Å; Q106-F188 HydrophobicContact CB-CZ 3.86Å; Q106-F188 HydrophobicContact CG-CE2 4.43Å; Q106-F188 HydrophobicContact CG-CZ 4.37Å; Q106-G276 PolarHBondContact NE2-O 2.89Å; Q106-G276 PolarHBondContact OE1-O 3.42Å; Q106-S277 PolarHBondContact NE2-OG 2.88Å; Q106-P394 HydrophobicContact CG-CG 4.37Å; Q106-L396 HydrophobicContact CG-CD1 4.42Å; Q106-L396 HydrophobicContact CG-CD2 4.45Å
107	N	95.2	Very high	97.3	Very high	140 Å²	140	42 Å²	42	75%	0.749	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	37.2	174	-59.4	-57.1	0	0	0	115.5	K104 R105	K104-N107 PolarHBondContact O-N 3.05Å; R105-N107 VanDerWaalsContact C-N 3.26Å; R105-N107 PolarHBondContact O-N 2.78Å
108	N	96.6	Very high	97.2	Very high	72 Å²	72	40.7 Å²	40.7	39%	0.385	20%	0.2	S	C	.	.			trans	51.4	58.3	172.4	-50.9	-64.4	0	0	0	114.3	W103 K104 K110	W103-N108 HydrophobicContact CD2-CB 4.39Å; W103-N108 HydrophobicContact CE3-CB 4.43Å; W103-N108 VanDerWaalsContact CE3-OD1 3.27Å; W103-N108 HydrophobicContact CH2-CB 3.59Å; W103-N108 WeakPolarHBondContact CH2-OD1 3.43Å; W103-N108 HydrophobicContact CZ2-CB 3.55Å; W103-N108 HydrophobicContact CZ3-CB 4.06Å; W103-N108 WeakPolarHBondContact CZ3-OD1 3.43Å; W103-N108 WeakPolarHBondContact O-CA 3.28Å; W103-N108 PolarHBondContact O-N 3.39Å; K104-N108 WeakPolarHBondContact CA-OD1 3.49Å; N108-K110 PolarHBondContact O-N 3.23Å
109	P	96.9	Very high	97	Very high	27 Å²	27	40.9 Å²	40.9	18%	0.175	20%	0.201	C	C	.	.			trans	-55.2	140.2	-178.5	-26.8	36.8	0	0	0	113	W103 Q106 H111 F188	W103-P109 PolarHBondContact NE1-O 3.47Å; Q106-P109 WeakPolarHBondContact O-CD 3.46Å; Q106-P109 WeakPolarHBondContact O-CG 3.45Å; P109-H111 VanDerWaalsContact C-N 3.27Å; P109-H111 PolarHBondContact O-N 2.9Å; P109-F188 HydrophobicContact CB-CB 4.49Å; P109-F188 HydrophobicContact CB-CD1 4.03Å; P109-F188 HydrophobicContact CB-CD2 4.14Å; P109-F188 HydrophobicContact CB-CE1 4.33Å; P109-F188 HydrophobicContact CB-CE2 4.4Å; P109-F188 HydrophobicContact CB-CG 3.95Å; P109-F188 HydrophobicContact CG-CD1 4.01Å; P109-F188 HydrophobicContact CG-CD2 3.7Å; P109-F188 HydrophobicContact CG-CE1 3.87Å; P109-F188 HydrophobicContact CG-CE2 3.51Å; P109-F188 HydrophobicContact CG-CG 3.95Å; P109-F188 HydrophobicContact CG-CZ 3.63Å
110	K	96.9	Very high	96.6	Very high	174 Å²	174	41.6 Å²	41.6	76%	0.757	21%	0.208	S	C	*	.	S	Bend	trans	-73.2	-15.4	-174.6	-65.2	-175.3	178.4	179.5	0	114.8	N108 T141	N108-K110 PolarHBondContact O-N 3.23Å; K110-T141 VanDerWaalsContact O-CB 3.25Å; K110-T141 WeakPolarHBondContact O-CB 3.21Å; K110-T141 VanDerWaalsContact O-CG2 3.31Å; K110-T141 WeakPolarHBondContact O-CG2 3.44Å
111	H	98	Very high	96.3	Very high	145 Å²	145	45.2 Å²	45.2	67%	0.671	22%	0.222	S	C	*	.			trans	-134.9	116.5	178.3	-59.8	-59.1	0	0	0	108	P109	P109-H111 VanDerWaalsContact C-N 3.27Å; P109-H111 PolarHBondContact O-N 2.9Å
112	L	98.6	Very high	96.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122	-179.5	168.1	59.3	0	0	0	109.3	F132 I138 T141 L142 S143 F188 F190	L112-F132 HydrophobicContact CD2-CE2 4.06Å; L112-I138 HydrophobicContact CD2-CD1 3.91Å; L112-I138 HydrophobicContact CD2-CG1 3.82Å; L112-T141 WeakPolarHBondContact CB-OG1 3.22Å; L112-T141 PolarHBondContact N-O 2.94Å; L112-L142 HydrophobicContact CD2-CD1 4.17Å; L112-L142 HydrophobicContact CG-CD1 4.17Å; L112-L142 CarbonylContact O-C 3.57Å; L112-L142 WeakPolarHBondContact O-CA 3.23Å; L112-S143 PolarHBondContact O-N 2.99Å; L112-F188 HydrophobicContact CD1-CD1 3.84Å; L112-F188 HydrophobicContact CD1-CE1 3.85Å; L112-F190 HydrophobicContact CD1-CB 4.29Å; L112-F190 HydrophobicContact CD1-CD1 4.42Å; L112-F190 HydrophobicContact CD1-CD2 3.39Å; L112-F190 HydrophobicContact CD1-CE2 3.73Å; L112-F190 HydrophobicContact CD1-CG 3.77Å; L112-F190 HydrophobicContact CD1-CZ 4.35Å; L112-F190 HydrophobicContact CD2-CD2 3.88Å; L112-F190 HydrophobicContact CD2-CE2 3.85Å; L112-F190 HydrophobicContact CG-CD2 4.25Å; L112-F190 HydrophobicContact CG-CE2 4.47Å
113	Q	98.9	Very high	96.2	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.037	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.6	167.2	-55.6	-177.9	-74.3	0	0	109.1	V115 S143 H145 P185 N187 F188 S189 F190	Q113-V115 HydrophobicContact CB-CG2 4.07Å; Q113-S143 CarbonylContact C-O 3.56Å; Q113-S143 WeakPolarHBondContact CA-O 3.39Å; Q113-H145 PolarHBondContact NE2-CE1 3.44Å; Q113-H145 VanDerWaalsContact NE2-CE1 3.28Å; Q113-H145 PolarHBondContact NE2-NE2 3.15Å; Q113-H145 VanDerWaalsContact NE2-NE2 3.17Å; Q113-P185 PolarHBondContact NE2-O 2.96Å; Q113-P185 PolarHBondContact OE1-O 2.93Å; Q113-N187 HydrophobicContact CG-CB 4.45Å; Q113-N187 PolarHBondContact OE1-O 3.02Å; Q113-F188 PolarHBondContact N-O 3.34Å; Q113-S189 CarbonylContact O-C 3.56Å; Q113-S189 VanDerWaalsContact O-CA 3.26Å; Q113-S189 WeakPolarHBondContact O-CA 3.43Å; Q113-S189 PolarHBondContact OE1-OG 2.79Å; Q113-F190 PolarHBondContact O-N 3.02Å
114	L	98.8	Very high	96.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	108	166.1	-179.7	66.6	0	0	0	108.3	L99 I128 L142 S143 H145 F190 I192	L99-L114 HydrophobicContact CD1-CD1 3.76Å; L114-I128 HydrophobicContact CD2-CB 4.36Å; L114-I128 HydrophobicContact CD2-CD1 4.46Å; L114-I128 HydrophobicContact CD2-CG2 3.75Å; L114-L142 HydrophobicContact CB-CD1 3.67Å; L114-S143 PolarHBondContact N-O 2.93Å; L114-H145 PolarHBondContact O-N 2.98Å; L114-F190 HydrophobicContact CD1-CB 4.28Å; L114-I192 HydrophobicContact CD1-CD1 4.05Å
115	V	98.9	Very high	96.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.3	-175.6	-170.1	0	0	0	0	109.3	Q113 L117 H145 V147 L181 V184 F190 F191 I192	Q113-V115 HydrophobicContact CB-CG2 4.07Å; V115-L117 HydrophobicContact CG1-CD2 4.45Å; V115-H145 CarbonylContact C-O 3.35Å; V115-H145 WeakPolarHBondContact CA-O 3.35Å; V115-H145 HydrophobicContact CB-CB 4.43Å; V115-H145 HydrophobicContact CG1-CB 4.36Å; V115-H145 HydrophobicContact CG2-CB 4.05Å; V115-V147 HydrophobicContact CG1-CG2 4.15Å; V115-L181 HydrophobicContact CG1-CD1 4.11Å; V115-V184 HydrophobicContact CG1-CG1 4.39Å; V115-V184 HydrophobicContact CG1-CG2 4.08Å; V115-V184 HydrophobicContact CG2-CG1 3.86Å; V115-F190 WeakPolarHBondContact CA-O 3.4Å; V115-F190 WeakPolarHBondContact CB-O 3.41Å; V115-F190 PolarHBondContact N-O 3.11Å; V115-F191 HydrophobicContact CB-CD1 3.56Å; V115-F191 HydrophobicContact CB-CE1 3.95Å; V115-F191 HydrophobicContact CB-CG 4.4Å; V115-F191 HydrophobicContact CG1-CD1 3.74Å; V115-F191 HydrophobicContact CG1-CE1 4.06Å; V115-F191 HydrophobicContact CG2-CD1 3.92Å; V115-F191 HydrophobicContact CG2-CE1 3.78Å; V115-F191 CarbonylContact O-C 3.53Å; V115-F191 VanDerWaalsContact O-CA 3.27Å; V115-F191 WeakPolarHBondContact O-CA 3.36Å; V115-I192 PolarHBondContact O-N 3.31Å
116	E	98.8	Very high	96.5	Very high	7 Å²	7	35.8 Å²	35.8	3%	0.033	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.8	177.3	-166	174.6	159.4	0	0	109.8	P119 C125 H145 L146 V147 I192	E116-P119 HydrophobicContact CB-CB 4.06Å; E116-P119 VanDerWaalsContact CD-CB 3.49Å; E116-P119 HydrophobicContact CG-CB 3.72Å; E116-P119 VanDerWaalsContact OE1-CA 3.31Å; E116-P119 WeakPolarHBondContact OE1-CA 3.45Å; E116-C125 VanDerWaalsContact OE2-CB 3.25Å; E116-C125 WeakPolarHBondContact OE2-CB 3.46Å; E116-C125 PolarHBondContact OE2-N 2.84Å; E116-H145 PolarHBondContact N-O 3.46Å; E116-L146 HydrophobicContact CB-CD2 3.95Å; E116-V147 PolarHBondContact O-N 3.05Å; E116-I192 HydrophobicContact CG-CB 4.49Å
117	L	98.4	Very high	96.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.1	177.7	-53.6	-178.2	0	0	0	108.8	V115 V147 L181 I192 F196 V263	V115-L117 HydrophobicContact CG1-CD2 4.45Å; L117-V147 HydrophobicContact CD2-CB 3.88Å; L117-V147 HydrophobicContact CD2-CG1 4.35Å; L117-V147 HydrophobicContact CD2-CG2 3.71Å; L117-L181 HydrophobicContact CD2-CB 4.36Å; L117-L181 HydrophobicContact CD2-CD1 4.11Å; L117-L181 HydrophobicContact CD2-CD2 4.43Å; L117-I192 PolarHBondContact N-O 3.08Å; L117-F196 HydrophobicContact CB-CB 4.49Å; L117-F196 HydrophobicContact CB-CD1 3.98Å; L117-F196 HydrophobicContact CB-CD2 3.69Å; L117-F196 HydrophobicContact CB-CE1 4.13Å; L117-F196 HydrophobicContact CB-CE2 3.84Å; L117-F196 HydrophobicContact CB-CG 3.76Å; L117-F196 HydrophobicContact CB-CZ 4.06Å; L117-F196 HydrophobicContact CD1-CD1 4.08Å; L117-F196 HydrophobicContact CD1-CE1 3.98Å; L117-F196 HydrophobicContact CD1-CZ 4.48Å; L117-V263 HydrophobicContact CD1-CG1 4.01Å
118	G	94.8	Very high	96.7	Very high	27 Å²	27	28.4 Å²	28.4	28%	0.278	15%	0.145	S	C	.	.	S	Bend	trans	59.1	60.7	-177.2	0	0	0	0	0	113	G120 V147	G118-G120 PolarHBondContact O-N 3.44Å; G118-V147 PolarHBondContact N-O 3.5Å
119	P	94.9	Very high	96.8	Very high	6 Å²	6	25 Å²	25	4%	0.039	13%	0.127	C	C	.	.			trans	-71.8	7.4	-168.3	30.8	-37.4	0	0	0	115.4	E116 R121 G122 L146 V147 Q157	E116-P119 HydrophobicContact CB-CB 4.06Å; E116-P119 VanDerWaalsContact CD-CB 3.49Å; E116-P119 HydrophobicContact CG-CB 3.72Å; E116-P119 VanDerWaalsContact OE1-CA 3.31Å; E116-P119 WeakPolarHBondContact OE1-CA 3.45Å; P119-R121 PolarHBondContact O-N 3.31Å; P119-R121 VanDerWaalsContact O-N 3.15Å; P119-G122 PolarHBondContact O-N 2.68Å; P119-L146 HydrophobicContact CB-CD2 3.96Å; P119-L146 HydrophobicContact CG-CB 4.05Å; P119-L146 HydrophobicContact CG-CD1 4.38Å; P119-L146 HydrophobicContact CG-CD2 4.08Å; P119-L146 HydrophobicContact CG-CG 4.37Å; P119-V147 WeakPolarHBondContact CD-O 3.35Å; P119-Q157 HydrophobicContact CG-CG 4.35Å
120	G	91.3	Very high	96.8	Very high	15 Å²	15	28 Å²	28	16%	0.155	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	-122	-176.5	0	0	0	0	0	111.5	G118 G122 M153 Q157	G118-G120 PolarHBondContact O-N 3.44Å; G120-G122 VanDerWaalsContact C-N 3.31Å; G120-G122 PolarHBondContact O-N 3.03Å; G120-M153 WeakPolarHBondContact O-CE 3.32Å; G120-Q157 WeakPolarHBondContact O-CG 3.01Å; G120-Q157 PolarHBondContact O-NE2 3.34Å
121	R	90.4	Very high	96.9	Very high	81 Å²	81	20.6 Å²	20.6	31%	0.306	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-4.7	179.2	-57.2	178.7	72.8	126.8	2.7	114.6	F75 E86 P119 T156 T160	F75-R121 HydrophobicContact CB-CG 3.8Å; F75-R121 HydrophobicContact CD1-CG 4.45Å; F75-R121 HydrophobicContact CD2-CG 4.12Å; F75-R121 HydrophobicContact CG-CG 3.87Å; E86-R121 WeakPolarHBondContact OE1-CD 3.42Å; P119-R121 PolarHBondContact O-N 3.31Å; P119-R121 VanDerWaalsContact O-N 3.15Å; R121-T156 HydrophobicContact CB-CG2 4.42Å; R121-T160 WeakPolarHBondContact O-CB 3.5Å; R121-T160 WeakPolarHBondContact O-CG2 3.33Å; R121-T160 PolarHBondContact O-OG1 3.43Å
122	G	94.8	Very high	96.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.072	C	C	.	.	S	Bend	trans	80.6	18.6	-172.2	0	0	0	0	0	114.1	P119 G120 S126	P119-G122 PolarHBondContact O-N 2.68Å; G120-G122 VanDerWaalsContact C-N 3.31Å; G120-G122 PolarHBondContact O-N 3.03Å; G122-S126 VanDerWaalsContact O-CB 3.31Å; G122-S126 WeakPolarHBondContact O-CB 3.37Å; G122-S126 PolarHBondContact O-N 2.96Å; G122-S126 PolarHBondContact O-OG 2.84Å
123	T	95.2	Very high	96.8	Very high	23 Å²	23	14 Å²	14	14%	0.141	7%	0.074	C	C	.	.	H	α-helix	trans	-69.7	-47.6	-178.3	-58.3	0	0	0	0	111.6	P85 E86 S126 D127	P85-T123 HydrophobicContact CB-CG2 4.14Å; E86-T123 WeakPolarHBondContact OE1-CB 3.27Å; E86-T123 PolarHBondContact OE1-OG1 3.02Å; T123-S126 WeakPolarHBondContact O-CA 3.34Å; T123-S126 WeakPolarHBondContact O-CB 3.28Å; T123-S126 PolarHBondContact O-N 3.06Å; T123-D127 PolarHBondContact O-N 2.82Å
124	L	97.4	Very high	96.7	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-60.3	-48.7	175.8	179	56.1	0	0	0	111.6	P85 F91 I95 S126 D127 I128 I192 H194	P85-L124 HydrophobicContact CB-CB 4.14Å; P85-L124 HydrophobicContact CG-CB 3.92Å; P85-L124 HydrophobicContact CG-CD1 4.43Å; F91-L124 HydrophobicContact CD1-CD1 4.33Å; F91-L124 HydrophobicContact CE1-CD1 4.34Å; I95-L124 HydrophobicContact CB-CD1 4.19Å; I95-L124 HydrophobicContact CG1-CD1 4.15Å; I95-L124 HydrophobicContact CG2-CD1 4.39Å; L124-S126 PolarHBondContact O-N 3.47Å; L124-D127 PolarHBondContact O-N 2.87Å; L124-D127 VanDerWaalsContact O-N 3.16Å; L124-I128 HydrophobicContact CD1-CD1 4.03Å; L124-I128 HydrophobicContact CD1-CG1 4.33Å; L124-I128 HydrophobicContact CG-CD1 3.97Å; L124-I128 WeakPolarHBondContact O-CG1 3.43Å; L124-I128 PolarHBondContact O-N 2.99Å; L124-I192 HydrophobicContact CD2-CG2 3.82Å; L124-H194 HydrophobicContact CD2-CB 4.12Å
125	C	98.1	Very high	96.7	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-50.9	-45.2	170.9	-170.4	0	0	0	0	112.2	E116 I128 L129 I161	E116-C125 VanDerWaalsContact OE2-CB 3.25Å; E116-C125 WeakPolarHBondContact OE2-CB 3.46Å; E116-C125 PolarHBondContact OE2-N 2.84Å; C125-I128 PolarHBondContact O-N 3.35Å; C125-L129 WeakPolarHBondContact O-CB 3.32Å; C125-L129 VanDerWaalsContact O-CG 3.28Å; C125-L129 WeakPolarHBondContact O-CG 3.15Å; C125-L129 PolarHBondContact O-N 3.29Å; C125-I161 HydrophobicContact CB-CD1 4.24Å; C125-I161 HydrophobicContact CB-CG1 4.49Å
126	S	97.7	Very high	96.5	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-38.8	-179.6	-65.6	0	0	0	0	113	G122 T123 L124 L129 R130 T164	G122-S126 VanDerWaalsContact O-CB 3.31Å; G122-S126 WeakPolarHBondContact O-CB 3.37Å; G122-S126 PolarHBondContact O-N 2.96Å; G122-S126 PolarHBondContact O-OG 2.84Å; T123-S126 WeakPolarHBondContact O-CA 3.34Å; T123-S126 WeakPolarHBondContact O-CB 3.28Å; T123-S126 PolarHBondContact O-N 3.06Å; L124-S126 PolarHBondContact O-N 3.47Å; S126-L129 PolarHBondContact O-N 2.86Å; S126-R130 WeakPolarHBondContact O-CG 3.08Å; S126-R130 PolarHBondContact O-N 3.15Å; S126-R130 PolarHBondContact O-NH1 3.46Å; S126-T164 WeakPolarHBondContact CB-OG1 3.48Å; S126-T164 PolarHBondContact OG-OG1 2.85Å
127	D	97.6	Very high	96.4	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.011	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-48	172.6	-78.1	-42.6	0	0	0	111.4	T123 L124 L129 R130 V131	T123-D127 PolarHBondContact O-N 2.82Å; L124-D127 PolarHBondContact O-N 2.87Å; L124-D127 VanDerWaalsContact O-N 3.16Å; D127-L129 VanDerWaalsContact C-N 3.3Å; D127-L129 PolarHBondContact O-N 2.9Å; D127-R130 WeakPolarHBondContact O-CB 3.25Å; D127-R130 PolarHBondContact O-N 2.88Å; D127-R130 VanDerWaalsContact O-N 3.11Å; D127-R130 IonicContact OD1-CZ 3.57Å; D127-R130 IonicContact OD1-NE 3.41Å; D127-R130 PolarHBondContact OD1-NE 3.16Å; D127-R130 IonicContact OD1-NH2 3.48Å; D127-R130 PolarHBondContact OD1-NH2 3.27Å; D127-V131 PolarHBondContact O-N 3.36Å
128	I	98.3	Very high	96.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-42.9	178.3	-65.7	163.9	0	0	0	110.3	I95 L99 L114 L124 C125 R130 V131 F132 I192	I95-I128 HydrophobicContact CG2-CD1 4.04Å; I95-I128 HydrophobicContact CG2-CG1 4.45Å; L99-I128 HydrophobicContact CD1-CD1 3.92Å; L99-I128 HydrophobicContact CD1-CG1 4.32Å; L99-I128 HydrophobicContact CD1-CG2 3.91Å; L114-I128 HydrophobicContact CD2-CB 4.36Å; L114-I128 HydrophobicContact CD2-CD1 4.46Å; L114-I128 HydrophobicContact CD2-CG2 3.75Å; L124-I128 HydrophobicContact CD1-CD1 4.03Å; L124-I128 HydrophobicContact CD1-CG1 4.33Å; L124-I128 HydrophobicContact CG-CD1 3.97Å; L124-I128 WeakPolarHBondContact O-CG1 3.43Å; L124-I128 PolarHBondContact O-N 2.99Å; C125-I128 PolarHBondContact O-N 3.35Å; I128-R130 VanDerWaalsContact C-N 3.34Å; I128-R130 PolarHBondContact O-N 3.38Å; I128-V131 PolarHBondContact O-N 3Å; I128-F132 HydrophobicContact CG2-CD1 4.28Å; I128-F132 HydrophobicContact CG2-CD2 4.11Å; I128-F132 HydrophobicContact CG2-CE1 4.11Å; I128-F132 HydrophobicContact CG2-CE2 3.93Å; I128-F132 HydrophobicContact CG2-CG 4.29Å; I128-F132 HydrophobicContact CG2-CZ 3.94Å; I128-F132 WeakPolarHBondContact O-CB 3.31Å; I128-F132 PolarHBondContact O-N 2.95Å; I128-I192 HydrophobicContact CD1-CD1 3.39Å
129	L	98.2	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-41.2	175.4	-75.7	170.2	0	0	0	112.6	C125 S126 D127 V131 F132 S133 Y139 L142 I144 I161 T164 L165 L168 P173	C125-L129 WeakPolarHBondContact O-CB 3.32Å; C125-L129 VanDerWaalsContact O-CG 3.28Å; C125-L129 WeakPolarHBondContact O-CG 3.15Å; C125-L129 PolarHBondContact O-N 3.29Å; S126-L129 PolarHBondContact O-N 2.86Å; D127-L129 VanDerWaalsContact C-N 3.3Å; D127-L129 PolarHBondContact O-N 2.9Å; L129-V131 VanDerWaalsContact C-N 3.34Å; L129-F132 PolarHBondContact O-N 3.33Å; L129-S133 VanDerWaalsContact O-CB 3.32Å; L129-S133 WeakPolarHBondContact O-CB 3.41Å; L129-S133 PolarHBondContact O-N 3.12Å; L129-Y139 HydrophobicContact CD2-CE2 4.13Å; L129-L142 HydrophobicContact CD2-CD2 3.53Å; L129-I144 HydrophobicContact CD1-CD1 3.72Å; L129-I144 HydrophobicContact CD2-CD1 3.78Å; L129-I144 HydrophobicContact CG-CD1 4.13Å; L129-I161 HydrophobicContact CD1-CG2 3.78Å; L129-T164 HydrophobicContact CB-CG2 4.5Å; L129-L165 HydrophobicContact CD1-CD2 4.06Å; L129-L165 HydrophobicContact CD1-CG 4.45Å; L129-L165 HydrophobicContact CD2-CD2 4.39Å; L129-L168 HydrophobicContact CB-CD1 4.49Å; L129-P173 HydrophobicContact CD2-CG 4.12Å
130	R	97.5	Very high	96.6	Very high	91 Å²	91	39.6 Å²	39.6	34%	0.343	20%	0.2	S	C	.	.	H	α-helix	trans	-61	-43.9	175.1	-77.6	-176.2	-75.9	-84.6	12.3	111.2	S126 D127 I128 S133 T164	S126-R130 WeakPolarHBondContact O-CG 3.08Å; S126-R130 PolarHBondContact O-N 3.15Å; S126-R130 PolarHBondContact O-NH1 3.46Å; D127-R130 WeakPolarHBondContact O-CB 3.25Å; D127-R130 PolarHBondContact O-N 2.88Å; D127-R130 VanDerWaalsContact O-N 3.11Å; D127-R130 IonicContact OD1-CZ 3.57Å; D127-R130 IonicContact OD1-NE 3.41Å; D127-R130 PolarHBondContact OD1-NE 3.16Å; D127-R130 IonicContact OD1-NH2 3.48Å; D127-R130 PolarHBondContact OD1-NH2 3.27Å; I128-R130 VanDerWaalsContact C-N 3.34Å; I128-R130 PolarHBondContact O-N 3.38Å; R130-S133 PolarHBondContact O-OG 3.3Å; R130-T164 HydrophobicContact CG-CG2 4.02Å; R130-T164 PolarHBondContact NH1-OG1 3.14Å
131	V	97.7	Very high	96.9	Very high	17 Å²	17	39.7 Å²	39.7	10%	0.103	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-55.2	175.9	176.2	0	0	0	0	110.5	E93 V97 D127 I128 L129 S133 K134 F135	E93-V131 HydrophobicContact CB-CG2 4.12Å; E93-V131 HydrophobicContact CG-CG2 4.13Å; V97-V131 HydrophobicContact CG2-CG1 4.21Å; D127-V131 PolarHBondContact O-N 3.36Å; I128-V131 PolarHBondContact O-N 3Å; L129-V131 VanDerWaalsContact C-N 3.34Å; V131-S133 PolarHBondContact O-N 2.92Å; V131-K134 WeakPolarHBondContact O-CB 3.22Å; V131-K134 PolarHBondContact O-N 3.17Å; V131-F135 HydrophobicContact CG1-CE2 4.26Å; V131-F135 WeakPolarHBondContact O-CD2 3.45Å
132	F	98.2	Very high	97.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-33.7	-178	-76.2	6.8	0	0	0	112.1	G96 L99 L100 L112 I128 L129 K134 F135 I138 Y139 L142	G96-F132 VanDerWaalsContact O-CE1 3.32Å; G96-F132 WeakPolarHBondContact O-CE1 3.25Å; L99-F132 HydrophobicContact CB-CE1 4.05Å; L99-F132 HydrophobicContact CB-CZ 3.7Å; L99-F132 HydrophobicContact CD1-CZ 4.13Å; L100-F132 HydrophobicContact CB-CE1 4.24Å; L112-F132 HydrophobicContact CD2-CE2 4.06Å; I128-F132 HydrophobicContact CG2-CD1 4.28Å; I128-F132 HydrophobicContact CG2-CD2 4.11Å; I128-F132 HydrophobicContact CG2-CE1 4.11Å; I128-F132 HydrophobicContact CG2-CE2 3.93Å; I128-F132 HydrophobicContact CG2-CG 4.29Å; I128-F132 HydrophobicContact CG2-CZ 3.94Å; I128-F132 WeakPolarHBondContact O-CB 3.31Å; I128-F132 PolarHBondContact O-N 2.95Å; L129-F132 PolarHBondContact O-N 3.33Å; F132-K134 PolarHBondContact O-N 3.17Å; F132-F135 CarbonylContact O-C 3.49Å; F132-F135 WeakPolarHBondContact O-CA 3.49Å; F132-F135 PolarHBondContact O-N 3.44Å; F132-F135 VanDerWaalsContact O-O 3.04Å; F132-I138 HydrophobicContact CB-CG2 4.23Å; F132-I138 HydrophobicContact CD1-CD1 4.21Å; F132-I138 HydrophobicContact CD1-CG2 4.19Å; F132-I138 HydrophobicContact CD2-CD1 4.22Å; F132-I138 HydrophobicContact CD2-CG1 4.27Å; F132-I138 HydrophobicContact CD2-CG2 4.48Å; F132-I138 HydrophobicContact CE1-CD1 3.7Å; F132-I138 HydrophobicContact CE2-CD1 3.74Å; F132-I138 HydrophobicContact CE2-CG1 4.13Å; F132-I138 HydrophobicContact CG-CD1 4.45Å; F132-I138 HydrophobicContact CG-CG2 4.07Å; F132-I138 HydrophobicContact CZ-CD1 3.45Å; F132-I138 VanDerWaalsContact CZ-CD1 3.45Å; F132-I138 HydrophobicContact CZ-CG1 4.32Å; F132-Y139 HydrophobicContact CB-CD2 3.91Å; F132-Y139 WeakPolarHBondContact O-CB 2.97Å; F132-L142 HydrophobicContact CD2-CD1 4.33Å; F132-L142 HydrophobicContact CD2-CD2 4.13Å; F132-L142 HydrophobicContact CE2-CD1 4.24Å
133	S	97.4	Very high	97.5	Very high	9 Å²	9	37.6 Å²	37.6	6%	0.063	19%	0.194	C	C	.	.	H	α-helix	trans	-56.4	-25.9	177.5	78.2	0	0	0	0	113.9	L129 R130 V131 F135 N170	L129-S133 VanDerWaalsContact O-CB 3.32Å; L129-S133 WeakPolarHBondContact O-CB 3.41Å; L129-S133 PolarHBondContact O-N 3.12Å; R130-S133 PolarHBondContact O-OG 3.3Å; V131-S133 PolarHBondContact O-N 2.92Å; S133-F135 VanDerWaalsContact C-N 3.28Å; S133-N170 PolarHBondContact O-ND2 2.91Å
134	K	97	Very high	97.6	Very high	159 Å²	159	36.5 Å²	36.5	69%	0.691	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-10.9	176.9	-53.3	-52.9	-179.5	-170.2	0	113.2	V131 F132	V131-K134 WeakPolarHBondContact O-CB 3.22Å; V131-K134 PolarHBondContact O-N 3.17Å; F132-K134 PolarHBondContact O-N 3.17Å
135	F	97.2	Very high	97.7	Very high	87 Å²	87	36.5 Å²	36.5	38%	0.382	19%	0.188	S	C	.	.			trans	-124.3	85.4	-180	-57.6	-81.3	0	0	0	109.2	L100 V131 F132 S133 E137 I138 Y139	L100-F135 HydrophobicContact CD1-CB 4.32Å; L100-F135 HydrophobicContact CD1-CG 4.26Å; L100-F135 HydrophobicContact CD2-CD1 3.98Å; L100-F135 HydrophobicContact CD2-CD2 3.61Å; L100-F135 HydrophobicContact CD2-CE1 3.88Å; L100-F135 HydrophobicContact CD2-CE2 3.52Å; L100-F135 HydrophobicContact CD2-CG 3.85Å; L100-F135 HydrophobicContact CD2-CZ 3.65Å; V131-F135 HydrophobicContact CG1-CE2 4.26Å; V131-F135 WeakPolarHBondContact O-CD2 3.45Å; F132-F135 CarbonylContact O-C 3.49Å; F132-F135 WeakPolarHBondContact O-CA 3.49Å; F132-F135 PolarHBondContact O-N 3.44Å; F132-F135 VanDerWaalsContact O-O 3.04Å; S133-F135 VanDerWaalsContact C-N 3.28Å; F135-E137 PolarHBondContact O-N 3Å; F135-I138 HydrophobicContact CB-CG2 3.78Å; F135-I138 VanDerWaalsContact O-CG2 3.3Å; F135-I138 WeakPolarHBondContact O-CG2 3.46Å; F135-I138 PolarHBondContact O-N 3.48Å; F135-Y139 PolarHBondContact O-N 2.97Å; F135-Y139 VanDerWaalsContact O-N 3.16Å
136	P	95.2	Very high	97.7	Very high	86 Å²	86	36.5 Å²	36.5	56%	0.558	19%	0.188	S	C	*	.	H	α-helix	trans	-55.4	-30.4	-173.3	-28.4	36	0	0	0	114.6	S140	P136-S140 VanDerWaalsContact O-CB 3.26Å; P136-S140 WeakPolarHBondContact O-CB 3.48Å; P136-S140 PolarHBondContact O-N 3.37Å; P136-S140 PolarHBondContact O-OG 3.05Å
137	E	96.7	Very high	97.8	Very high	147 Å²	147	37 Å²	37	69%	0.687	19%	0.191	S	C	*	.	H	α-helix	trans	-59.3	-58.1	179.6	-62	178.8	-112.5	0	0	111.4	W103 F135 S140 T141	W103-E137 HydrophobicContact CH2-CB 3.78Å; W103-E137 HydrophobicContact CZ3-CB 4.38Å; F135-E137 PolarHBondContact O-N 3Å; E137-S140 PolarHBondContact O-OG 3.43Å; E137-T141 WeakPolarHBondContact O-CG2 3.5Å
138	I	98	Very high	97.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-41.8	177.4	-170.2	169.5	0	0	0	111.6	L100 W103 L112 F132 F135 S140 T141	L100-I138 HydrophobicContact CD1-CB 4.27Å; L100-I138 HydrophobicContact CD1-CD1 4.07Å; L100-I138 HydrophobicContact CD1-CG2 3.85Å; W103-I138 HydrophobicContact CB-CD1 3.61Å; W103-I138 HydrophobicContact CB-CG1 4.45Å; W103-I138 HydrophobicContact CD2-CB 3.87Å; W103-I138 HydrophobicContact CD2-CD1 3.74Å; W103-I138 HydrophobicContact CD2-CG1 3.71Å; W103-I138 HydrophobicContact CE3-CB 3.81Å; W103-I138 HydrophobicContact CE3-CD1 4.03Å; W103-I138 HydrophobicContact CE3-CG1 4.1Å; W103-I138 HydrophobicContact CG-CD1 3.55Å; W103-I138 HydrophobicContact CG-CG1 3.87Å; W103-I138 HydrophobicContact CH2-CB 4.13Å; W103-I138 HydrophobicContact CZ2-CB 4.16Å; W103-I138 HydrophobicContact CZ3-CB 3.93Å; L112-I138 HydrophobicContact CD2-CD1 3.91Å; L112-I138 HydrophobicContact CD2-CG1 3.82Å; F132-I138 HydrophobicContact CB-CG2 4.23Å; F132-I138 HydrophobicContact CD1-CD1 4.21Å; F132-I138 HydrophobicContact CD1-CG2 4.19Å; F132-I138 HydrophobicContact CD2-CD1 4.22Å; F132-I138 HydrophobicContact CD2-CG1 4.27Å; F132-I138 HydrophobicContact CD2-CG2 4.48Å; F132-I138 HydrophobicContact CE1-CD1 3.7Å; F132-I138 HydrophobicContact CE2-CD1 3.74Å; F132-I138 HydrophobicContact CE2-CG1 4.13Å; F132-I138 HydrophobicContact CG-CD1 4.45Å; F132-I138 HydrophobicContact CG-CG2 4.07Å; F132-I138 HydrophobicContact CZ-CD1 3.45Å; F132-I138 VanDerWaalsContact CZ-CD1 3.45Å; F132-I138 HydrophobicContact CZ-CG1 4.32Å; F135-I138 HydrophobicContact CB-CG2 3.78Å; F135-I138 VanDerWaalsContact O-CG2 3.3Å; F135-I138 WeakPolarHBondContact O-CG2 3.46Å; F135-I138 PolarHBondContact O-N 3.48Å; I138-S140 PolarHBondContact O-N 2.98Å; I138-T141 PolarHBondContact O-N 3.35Å; I138-T141 PolarHBondContact O-OG1 3.4Å
139	Y	98.2	Very high	97.2	Very high	9 Å²	9	42.1 Å²	42.1	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-35.7	-175.8	-170.4	-85.9	0	0	0	112.1	L129 F132 F135 T141 L142 L165 L168 N170 K171	L129-Y139 HydrophobicContact CD2-CE2 4.13Å; F132-Y139 HydrophobicContact CB-CD2 3.91Å; F132-Y139 WeakPolarHBondContact O-CB 2.97Å; F135-Y139 PolarHBondContact O-N 2.97Å; F135-Y139 VanDerWaalsContact O-N 3.16Å; Y139-T141 PolarHBondContact O-N 3.33Å; Y139-L142 WeakPolarHBondContact O-CB 2.94Å; Y139-L142 PolarHBondContact O-N 3.14Å; Y139-L165 WeakPolarHBondContact OH-CD2 3.39Å; Y139-L168 HydrophobicContact CE2-CD1 4.16Å; Y139-N170 HydrophobicContact CD1-CB 3.59Å; Y139-N170 HydrophobicContact CE1-CB 3.15Å; Y139-N170 HydrophobicContact CG-CB 4.44Å; Y139-K171 VanDerWaalsContact CE1-O 3.28Å; Y139-K171 WeakPolarHBondContact CE1-O 3.41Å
140	S	97.1	Very high	96.7	Very high	98 Å²	98	42.2 Å²	42.2	69%	0.685	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.4	178.6	72.7	0	0	0	0	114.4	P136 E137 I138	P136-S140 VanDerWaalsContact O-CB 3.26Å; P136-S140 WeakPolarHBondContact O-CB 3.48Å; P136-S140 PolarHBondContact O-N 3.37Å; P136-S140 PolarHBondContact O-OG 3.05Å; E137-S140 PolarHBondContact O-OG 3.43Å; I138-S140 PolarHBondContact O-N 2.98Å
141	T	97.6	Very high	96.1	Very high	18 Å²	18	44.1 Å²	44.1	11%	0.11	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.6	-179.2	70.7	0	0	0	0	113.5	W103 K110 L112 E137 I138 Y139	W103-T141 HydrophobicContact CZ2-CG2 4.37Å; K110-T141 VanDerWaalsContact O-CB 3.25Å; K110-T141 WeakPolarHBondContact O-CB 3.21Å; K110-T141 VanDerWaalsContact O-CG2 3.31Å; K110-T141 WeakPolarHBondContact O-CG2 3.44Å; L112-T141 WeakPolarHBondContact CB-OG1 3.22Å; L112-T141 PolarHBondContact N-O 2.94Å; E137-T141 WeakPolarHBondContact O-CG2 3.5Å; I138-T141 PolarHBondContact O-N 3.35Å; I138-T141 PolarHBondContact O-OG1 3.4Å; Y139-T141 PolarHBondContact O-N 3.33Å
142	L	98.2	Very high	95.4	Very high	13 Å²	13	46 Å²	46	7%	0.068	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	133.2	-161.2	-171.6	66.9	0	0	0	113.7	L112 L114 L129 F132 Y139 I144 P173	L112-L142 HydrophobicContact CD2-CD1 4.17Å; L112-L142 HydrophobicContact CG-CD1 4.17Å; L112-L142 CarbonylContact O-C 3.57Å; L112-L142 WeakPolarHBondContact O-CA 3.23Å; L114-L142 HydrophobicContact CB-CD1 3.67Å; L129-L142 HydrophobicContact CD2-CD2 3.53Å; F132-L142 HydrophobicContact CD2-CD1 4.33Å; F132-L142 HydrophobicContact CD2-CD2 4.13Å; F132-L142 HydrophobicContact CE2-CD1 4.24Å; Y139-L142 WeakPolarHBondContact O-CB 2.94Å; Y139-L142 PolarHBondContact O-N 3.14Å; L142-I144 HydrophobicContact CD2-CG1 4.37Å; L142-I144 HydrophobicContact CG-CG1 4.44Å; L142-P173 HydrophobicContact CB-CB 4.21Å; L142-P173 HydrophobicContact CD2-CB 4.28Å; L142-P173 HydrophobicContact CD2-CG 4.18Å; L142-P173 HydrophobicContact CG-CB 4.21Å; L142-P173 WeakPolarHBondContact O-CB 3.35Å
143	S	98.6	Very high	94.9	Very high	23 Å²	23	46.6 Å²	46.6	16%	0.161	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143	153.1	64.5	0	0	0	0	110.2	L112 Q113 L114 H145	L112-S143 PolarHBondContact O-N 2.99Å; Q113-S143 CarbonylContact C-O 3.56Å; Q113-S143 WeakPolarHBondContact CA-O 3.39Å; L114-S143 PolarHBondContact N-O 2.93Å; S143-H145 PolarHBondContact OG-CD2 2.89Å; S143-H145 PolarHBondContact OG-NE2 3.41Å
144	I	98.7	Very high	94.7	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	130.9	-179.1	-52.4	179.5	0	0	0	109	L129 L142 L146 I161 P173 L174 I175 F176	L129-I144 HydrophobicContact CD1-CD1 3.72Å; L129-I144 HydrophobicContact CD2-CD1 3.78Å; L129-I144 HydrophobicContact CG-CD1 4.13Å; L142-I144 HydrophobicContact CD2-CG1 4.37Å; L142-I144 HydrophobicContact CG-CG1 4.44Å; I144-L146 HydrophobicContact CG2-CD2 3.77Å; I144-L146 HydrophobicContact CG2-CG 3.97Å; I144-I161 HydrophobicContact CD1-CG2 4.36Å; I144-P173 HydrophobicContact CD1-CG 3.79Å; I144-P173 HydrophobicContact CG1-CB 4.41Å; I144-P173 HydrophobicContact CG1-CG 4Å; I144-L174 PolarHBondContact N-O 3.32Å; I144-I175 HydrophobicContact CB-CB 4.46Å; I144-I175 HydrophobicContact CB-CG1 4.32Å; I144-I175 HydrophobicContact CB-CG2 4.15Å; I144-I175 HydrophobicContact CD1-CD1 4.38Å; I144-I175 HydrophobicContact CD1-CG1 4.11Å; I144-I175 HydrophobicContact CG2-CG2 4.21Å; I144-I175 CarbonylContact O-C 3.49Å; I144-I175 WeakPolarHBondContact O-CA 3.36Å; I144-F176 PolarHBondContact O-N 3.46Å
145	H	98.8	Very high	94.4	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.019	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	110.3	179.3	-67.7	-103.1	0	0	0	109.3	Q113 L114 V115 E116 S143 F176 H178 V184	Q113-H145 PolarHBondContact NE2-CE1 3.44Å; Q113-H145 VanDerWaalsContact NE2-CE1 3.28Å; Q113-H145 PolarHBondContact NE2-NE2 3.15Å; Q113-H145 VanDerWaalsContact NE2-NE2 3.17Å; L114-H145 PolarHBondContact O-N 2.98Å; V115-H145 CarbonylContact C-O 3.35Å; V115-H145 WeakPolarHBondContact CA-O 3.35Å; V115-H145 HydrophobicContact CB-CB 4.43Å; V115-H145 HydrophobicContact CG1-CB 4.36Å; V115-H145 HydrophobicContact CG2-CB 4.05Å; E116-H145 PolarHBondContact N-O 3.46Å; S143-H145 PolarHBondContact OG-CD2 2.89Å; S143-H145 PolarHBondContact OG-NE2 3.41Å; H145-F176 WeakPolarHBondContact CA-O 3.31Å; H145-F176 AromaticContact CE1-CD2 3.53Å; H145-F176 AromaticContact NE2-CD2 3.74Å; H145-H178 AromaticContact CG-NE2 3.83Å; H145-H178 AromaticContact ND1-CD2 3.95Å; H145-H178 AromaticContact ND1-CE1 3.82Å; H145-H178 AromaticContact ND1-NE2 3.04Å; H145-H178 PolarHBondContact ND1-NE2 2.93Å; H145-V184 HydrophobicContact CB-CG1 4.18Å; H145-V184 HydrophobicContact CB-CG2 4.48Å
146	L	98.7	Very high	94.2	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.8	-177.2	-62.3	-173.3	0	0	0	109.5	E116 P119 I144 Q157 I161 F176 W177 H178	E116-L146 HydrophobicContact CB-CD2 3.95Å; P119-L146 HydrophobicContact CB-CD2 3.96Å; P119-L146 HydrophobicContact CG-CB 4.05Å; P119-L146 HydrophobicContact CG-CD1 4.38Å; P119-L146 HydrophobicContact CG-CD2 4.08Å; P119-L146 HydrophobicContact CG-CG 4.37Å; I144-L146 HydrophobicContact CG2-CD2 3.77Å; I144-L146 HydrophobicContact CG2-CG 3.97Å; L146-Q157 HydrophobicContact CD1-CB 4.23Å; L146-I161 HydrophobicContact CD1-CD1 3.59Å; L146-F176 PolarHBondContact N-O 3.17Å; L146-W177 HydrophobicContact CB-CG 4.39Å; L146-W177 HydrophobicContact CD1-CZ2 4.12Å; L146-W177 CarbonylContact O-C 3.6Å; L146-W177 WeakPolarHBondContact O-CA 3.42Å; L146-H178 PolarHBondContact O-N 3.07Å
147	V	98.2	Very high	94.1	Very high	13 Å²	13	41.2 Å²	41.2	8%	0.079	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	102.1	177.1	-175.4	0	0	0	0	108.5	V115 E116 L117 G118 P119 H178 V184	V115-V147 HydrophobicContact CG1-CG2 4.15Å; E116-V147 PolarHBondContact O-N 3.05Å; L117-V147 HydrophobicContact CD2-CB 3.88Å; L117-V147 HydrophobicContact CD2-CG1 4.35Å; L117-V147 HydrophobicContact CD2-CG2 3.71Å; G118-V147 PolarHBondContact N-O 3.5Å; P119-V147 WeakPolarHBondContact CD-O 3.35Å; V147-H178 CarbonylContact C-O 3.58Å; V147-H178 WeakPolarHBondContact CA-O 3.46Å; V147-H178 HydrophobicContact CG2-CB 4.34Å; V147-V184 HydrophobicContact CG2-CG2 3.97Å
148	E	94.2	Very high	94.1	Very high	20 Å²	20	38.8 Å²	38.8	9%	0.093	20%	0.204	C	C	.	.			trans	-143.5	124	-172.5	175.5	58.9	-101	0	0	111.2	S150 M153 R154 Q157 H178	E148-S150 WeakPolarHBondContact CG-O 3.45Å; E148-S150 WeakPolarHBondContact OE1-CB 3.29Å; E148-S150 PolarHBondContact OE1-N 3.48Å; E148-M153 HydrophobicContact CG-CB 4.01Å; E148-R154 HydrophobicContact CB-CG 4.03Å; E148-R154 HydrophobicContact CG-CG 3.66Å; E148-R154 PolarHBondContact O-NH1 3.39Å; E148-R154 VanDerWaalsContact O-NH1 3.07Å; E148-Q157 PolarHBondContact OE2-NE2 3.16Å; E148-H178 PolarHBondContact N-O 3.31Å
149	I	89.8	Confident	94	Very high	89 Å²	89	45.1 Å²	45.1	46%	0.456	23%	0.234	S	C	.	.			trans	-81.1	-34	178.8	61.5	172.7	0	0	0	112
150	S	87	Confident	93.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.007	24%	0.242	C	C	.	.			trans	-83	118.2	-172.2	177.4	0	0	0	0	112.1	Y69 E148 S152 M153 R154	Y69-S150 WeakPolarHBondContact O-CB 3.29Å; Y69-S150 PolarHBondContact O-OG 3.19Å; E148-S150 WeakPolarHBondContact CG-O 3.45Å; E148-S150 WeakPolarHBondContact OE1-CB 3.29Å; E148-S150 PolarHBondContact OE1-N 3.48Å; S150-S152 VanDerWaalsContact C-N 3.34Å; S150-S152 PolarHBondContact O-N 2.97Å; S150-S152 PolarHBondContact OG-OG 3.44Å; S150-S152 VanDerWaalsContact OG-OG 3.07Å; S150-M153 PolarHBondContact O-N 2.87Å; S150-R154 WeakPolarHBondContact O-CG 3.49Å; S150-R154 PolarHBondContact O-N 3.41Å
151	Q	84.8	Confident	93.9	Very high	132 Å²	132	41.6 Å²	41.6	62%	0.617	21%	0.209	S	C	*	.	H	α-helix	trans	-65.6	-35.1	-177.9	-176	173.1	8.4	0	0	113.1	R154	Q151-R154 PolarHBondContact O-N 3.26Å
152	S	84.1	Confident	93.8	Very high	55 Å²	55	45.4 Å²	45.4	39%	0.385	23%	0.226	S	C	.	.	H	α-helix	trans	-66.3	-42.5	176.8	55.1	0	0	0	0	110.7	S150 R154 Q155 T156	S150-S152 VanDerWaalsContact C-N 3.34Å; S150-S152 PolarHBondContact O-N 2.97Å; S150-S152 PolarHBondContact OG-OG 3.44Å; S150-S152 VanDerWaalsContact OG-OG 3.07Å; S152-R154 VanDerWaalsContact C-N 3.31Å; S152-R154 PolarHBondContact O-N 3.42Å; S152-Q155 WeakPolarHBondContact O-CB 3.44Å; S152-Q155 PolarHBondContact O-N 3.05Å; S152-Q155 VanDerWaalsContact O-N 3.12Å; S152-T156 PolarHBondContact O-N 3Å
153	M	87.8	Confident	93.8	Very high	14 Å²	14	51.3 Å²	51.3	7%	0.069	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-38.3	176.7	-71.5	-54.2	-53.4	0	0	112.6	F75 G120 E148 S150 Q155 T156 Q157	F75-M153 HydrophobicContact CD2-CE 3.54Å; F75-M153 HydrophobicContact CD2-SD 3.86Å; F75-M153 HydrophobicContact CE2-CE 3.51Å; F75-M153 HydrophobicContact CE2-SD 3.99Å; G120-M153 WeakPolarHBondContact O-CE 3.32Å; E148-M153 HydrophobicContact CG-CB 4.01Å; S150-M153 PolarHBondContact O-N 2.87Å; M153-Q155 VanDerWaalsContact C-N 3.26Å; M153-Q155 PolarHBondContact O-N 3.41Å; M153-T156 WeakPolarHBondContact O-CB 3.31Å; M153-T156 PolarHBondContact O-N 3.32Å; M153-T156 VanDerWaalsContact O-N 3.16Å; M153-Q157 VanDerWaalsContact O-CD 3.29Å; M153-Q157 WeakPolarHBondContact O-CG 3.38Å; M153-Q157 PolarHBondContact O-N 3.47Å
154	R	92.7	Very high	93.7	Very high	61 Å²	61	51 Å²	51	23%	0.23	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-37.2	174.7	-65.5	-165.8	-72.9	-118.5	1.7	113.4	E148 S150 Q151 S152 K158 W177	E148-R154 HydrophobicContact CB-CG 4.03Å; E148-R154 HydrophobicContact CG-CG 3.66Å; E148-R154 PolarHBondContact O-NH1 3.39Å; E148-R154 VanDerWaalsContact O-NH1 3.07Å; S150-R154 WeakPolarHBondContact O-CG 3.49Å; S150-R154 PolarHBondContact O-N 3.41Å; Q151-R154 PolarHBondContact O-N 3.26Å; S152-R154 VanDerWaalsContact C-N 3.31Å; S152-R154 PolarHBondContact O-N 3.42Å; R154-K158 WeakPolarHBondContact O-CB 3.39Å; R154-K158 PolarHBondContact O-N 3.02Å; R154-W177 HydrophobicContact CB-CG 4.4Å; R154-W177 VanDerWaalsContact CD-CD1 3.47Å; R154-W177 HydrophobicContact CG-CB 4.5Å; R154-W177 VanDerWaalsContact CG-CD1 3.4Å; R154-W177 HydrophobicContact CG-CG 4.04Å
155	Q	91.6	Very high	93.6	Very high	122 Å²	122	51.9 Å²	51.9	57%	0.57	25%	0.252	S	S	*	.	H	α-helix	trans	-68.3	-44.1	177.3	-66	-179.3	-13.7	0	0	111.4	S152 M153 K158 Q159	S152-Q155 WeakPolarHBondContact O-CB 3.44Å; S152-Q155 PolarHBondContact O-N 3.05Å; S152-Q155 VanDerWaalsContact O-N 3.12Å; M153-Q155 VanDerWaalsContact C-N 3.26Å; M153-Q155 PolarHBondContact O-N 3.41Å; Q155-K158 PolarHBondContact O-N 3.35Å; Q155-Q159 WeakPolarHBondContact O-CG 3.49Å; Q155-Q159 PolarHBondContact O-N 3.01Å
156	T	91.4	Very high	93.5	Very high	45 Å²	45	55.8 Å²	55.8	28%	0.276	28%	0.28	S	S	.	.	H	α-helix	trans	-59.4	-48.7	175	-58.6	0	0	0	0	111.3	R121 S152 M153 K158 Q159 T160	R121-T156 HydrophobicContact CB-CG2 4.42Å; S152-T156 PolarHBondContact O-N 3Å; M153-T156 WeakPolarHBondContact O-CB 3.31Å; M153-T156 PolarHBondContact O-N 3.32Å; M153-T156 VanDerWaalsContact O-N 3.16Å; T156-K158 VanDerWaalsContact C-N 3.33Å; T156-K158 PolarHBondContact O-N 2.91Å; T156-Q159 PolarHBondContact O-N 2.96Å; T156-T160 PolarHBondContact O-N 3.34Å; T156-T160 PolarHBondContact O-OG1 2.7Å; T156-T160 VanDerWaalsContact O-OG1 3.04Å
157	Q	95.1	Very high	93.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.1	-47.2	177.1	-68.9	155.1	12.6	0	0	111.5	P119 G120 L146 E148 M153 Q159 T160 I161	P119-Q157 HydrophobicContact CG-CG 4.35Å; G120-Q157 WeakPolarHBondContact O-CG 3.01Å; G120-Q157 PolarHBondContact O-NE2 3.34Å; L146-Q157 HydrophobicContact CD1-CB 4.23Å; E148-Q157 PolarHBondContact OE2-NE2 3.16Å; M153-Q157 VanDerWaalsContact O-CD 3.29Å; M153-Q157 WeakPolarHBondContact O-CG 3.38Å; M153-Q157 PolarHBondContact O-N 3.47Å; Q157-Q159 VanDerWaalsContact C-N 3.35Å; Q157-Q159 PolarHBondContact O-N 3.5Å; Q157-T160 PolarHBondContact O-N 3.21Å; Q157-I161 WeakPolarHBondContact O-CB 3.33Å; Q157-I161 VanDerWaalsContact O-CG1 3.29Å; Q157-I161 WeakPolarHBondContact O-CG1 3.23Å; Q157-I161 PolarHBondContact O-N 3.21Å
158	K	96	Very high	93.2	Very high	95 Å²	95	62.8 Å²	62.8	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-56	-49.7	177.5	-178.9	176.8	178.2	-179.7	0	111.2	R154 Q155 T156 I161 E162 W177	R154-K158 WeakPolarHBondContact O-CB 3.39Å; R154-K158 PolarHBondContact O-N 3.02Å; Q155-K158 PolarHBondContact O-N 3.35Å; T156-K158 VanDerWaalsContact C-N 3.33Å; T156-K158 PolarHBondContact O-N 2.91Å; K158-I161 PolarHBondContact O-N 2.9Å; K158-E162 WeakPolarHBondContact CE-OE1 3.31Å; K158-E162 WeakPolarHBondContact CE-OE2 3.44Å; K158-E162 HydrophobicContact CG-CG 4.18Å; K158-E162 IonicContact NZ-OE1 2.74Å; K158-E162 VanDerWaalsContact O-CB 3.25Å; K158-E162 WeakPolarHBondContact O-CB 3.23Å; K158-E162 VanDerWaalsContact O-CG 3.27Å; K158-E162 WeakPolarHBondContact O-CG 3.5Å; K158-E162 PolarHBondContact O-N 2.8Å; K158-W177 HydrophobicContact CB-CH2 3.88Å; K158-W177 HydrophobicContact CB-CZ2 3.78Å; K158-W177 HydrophobicContact CD-CH2 4.45Å; K158-W177 HydrophobicContact CG-CH2 4.04Å; K158-W177 HydrophobicContact CG-CZ2 4.45Å
159	Q	95.4	Very high	93.1	Very high	133 Å²	133	70 Å²	70	62%	0.621	35%	0.352	S	S	*	.	H	α-helix	trans	-62	-45.5	179.4	-70	172.5	0.7	0	0	112.3	Q155 T156 Q157 K163	Q155-Q159 WeakPolarHBondContact O-CG 3.49Å; Q155-Q159 PolarHBondContact O-N 3.01Å; T156-Q159 PolarHBondContact O-N 2.96Å; Q157-Q159 VanDerWaalsContact C-N 3.35Å; Q157-Q159 PolarHBondContact O-N 3.5Å; Q159-K163 VanDerWaalsContact O-CB 3.26Å; Q159-K163 WeakPolarHBondContact O-CB 3.46Å; Q159-K163 PolarHBondContact O-N 2.85Å
160	T	95.5	Very high	93.3	Very high	34 Å²	34	67.8 Å²	67.8	21%	0.209	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-47.2	178.3	-56.4	0	0	0	0	111.5	R121 T156 Q157 T164	R121-T160 WeakPolarHBondContact O-CB 3.5Å; R121-T160 WeakPolarHBondContact O-CG2 3.33Å; R121-T160 PolarHBondContact O-OG1 3.43Å; T156-T160 PolarHBondContact O-N 3.34Å; T156-T160 PolarHBondContact O-OG1 2.7Å; T156-T160 VanDerWaalsContact O-OG1 3.04Å; Q157-T160 PolarHBondContact O-N 3.21Å; T160-T164 PolarHBondContact O-N 3.43Å; T160-T164 VanDerWaalsContact O-N 3.1Å; T160-T164 PolarHBondContact O-OG1 2.85Å
161	I	97.4	Very high	93.7	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-72.4	-45	-176.9	-65.1	165.6	0	0	0	110.7	C125 L129 I144 L146 Q157 K158 K163 T164 L165 I175	C125-I161 HydrophobicContact CB-CD1 4.24Å; C125-I161 HydrophobicContact CB-CG1 4.49Å; L129-I161 HydrophobicContact CD1-CG2 3.78Å; I144-I161 HydrophobicContact CD1-CG2 4.36Å; L146-I161 HydrophobicContact CD1-CD1 3.59Å; Q157-I161 WeakPolarHBondContact O-CB 3.33Å; Q157-I161 VanDerWaalsContact O-CG1 3.29Å; Q157-I161 WeakPolarHBondContact O-CG1 3.23Å; Q157-I161 PolarHBondContact O-N 3.21Å; K158-I161 PolarHBondContact O-N 2.9Å; I161-K163 VanDerWaalsContact C-N 3.3Å; I161-K163 PolarHBondContact O-N 2.96Å; I161-T164 WeakPolarHBondContact O-CB 3.26Å; I161-T164 PolarHBondContact O-N 3.05Å; I161-T164 VanDerWaalsContact O-N 3.1Å; I161-L165 HydrophobicContact CG2-CD1 3.87Å; I161-L165 HydrophobicContact CG2-CG 4.13Å; I161-L165 VanDerWaalsContact O-CG 3.31Å; I161-L165 WeakPolarHBondContact O-CG 3Å; I161-L165 PolarHBondContact O-N 2.84Å; I161-I175 HydrophobicContact CG2-CD1 3.62Å
162	E	96.6	Very high	94.3	Very high	98 Å²	98	74.3 Å²	74.3	46%	0.458	38%	0.375	S	S	.	.	H	α-helix	trans	-60.5	-39.3	176.7	-75.4	-179.9	160.1	0	0	111.8	K158 L165 S166	K158-E162 WeakPolarHBondContact CE-OE1 3.31Å; K158-E162 WeakPolarHBondContact CE-OE2 3.44Å; K158-E162 HydrophobicContact CG-CG 4.18Å; K158-E162 IonicContact NZ-OE1 2.74Å; K158-E162 VanDerWaalsContact O-CB 3.25Å; K158-E162 WeakPolarHBondContact O-CB 3.23Å; K158-E162 VanDerWaalsContact O-CG 3.27Å; K158-E162 WeakPolarHBondContact O-CG 3.5Å; K158-E162 PolarHBondContact O-N 2.8Å; E162-L165 PolarHBondContact O-N 3.17Å; E162-S166 WeakPolarHBondContact O-CB 3.47Å; E162-S166 PolarHBondContact O-N 2.95Å
163	K	97.1	Very high	94.9	Very high	137 Å²	137	72.5 Å²	72.5	60%	0.596	36%	0.362	S	S	*	.	H	α-helix	trans	-58.6	-49.9	172	-178.9	-178.3	177.5	-175.8	0	110.9	Q159 I161 L165 S166 H167	Q159-K163 VanDerWaalsContact O-CB 3.26Å; Q159-K163 WeakPolarHBondContact O-CB 3.46Å; Q159-K163 PolarHBondContact O-N 2.85Å; I161-K163 VanDerWaalsContact C-N 3.3Å; I161-K163 PolarHBondContact O-N 2.96Å; K163-L165 PolarHBondContact O-N 3.02Å; K163-S166 PolarHBondContact O-N 3.39Å; K163-S166 PolarHBondContact O-OG 2.98Å; K163-H167 PolarHBondContact O-CD2 3.43Å
164	T	97.3	Very high	95.4	Very high	15 Å²	15	77.6 Å²	77.6	9%	0.092	39%	0.389	C	S	.	.	H	α-helix	trans	-58.2	-49.3	177.2	-63.6	0	0	0	0	111.2	S126 L129 R130 T160 I161 S166 H167 L168	S126-T164 WeakPolarHBondContact CB-OG1 3.48Å; S126-T164 PolarHBondContact OG-OG1 2.85Å; L129-T164 HydrophobicContact CB-CG2 4.5Å; R130-T164 HydrophobicContact CG-CG2 4.02Å; R130-T164 PolarHBondContact NH1-OG1 3.14Å; T160-T164 PolarHBondContact O-N 3.43Å; T160-T164 VanDerWaalsContact O-N 3.1Å; T160-T164 PolarHBondContact O-OG1 2.85Å; I161-T164 WeakPolarHBondContact O-CB 3.26Å; I161-T164 PolarHBondContact O-N 3.05Å; I161-T164 VanDerWaalsContact O-N 3.1Å; T164-S166 VanDerWaalsContact C-N 3.28Å; T164-S166 PolarHBondContact O-N 2.95Å; T164-H167 PolarHBondContact O-N 3.28Å; T164-H167 VanDerWaalsContact O-N 3.1Å; T164-L168 WeakPolarHBondContact O-CG 3.4Å
165	L	96.9	Very high	95.7	Very high	20 Å²	20	76.5 Å²	76.5	11%	0.105	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-35.4	179.6	-68.6	175.7	0	0	0	112.7	L129 Y139 I161 E162 K163 H167 L168 P172 P173 I175	L129-L165 HydrophobicContact CD1-CD2 4.06Å; L129-L165 HydrophobicContact CD1-CG 4.45Å; L129-L165 HydrophobicContact CD2-CD2 4.39Å; Y139-L165 WeakPolarHBondContact OH-CD2 3.39Å; I161-L165 HydrophobicContact CG2-CD1 3.87Å; I161-L165 HydrophobicContact CG2-CG 4.13Å; I161-L165 VanDerWaalsContact O-CG 3.31Å; I161-L165 WeakPolarHBondContact O-CG 3Å; I161-L165 PolarHBondContact O-N 2.84Å; E162-L165 PolarHBondContact O-N 3.17Å; K163-L165 PolarHBondContact O-N 3.02Å; L165-H167 PolarHBondContact O-N 3.04Å; L165-L168 HydrophobicContact CD2-CD1 4.17Å; L165-L168 PolarHBondContact O-N 3.07Å; L165-L168 VanDerWaalsContact O-N 3.08Å; L165-P172 HydrophobicContact CD1-CB 4.03Å; L165-P172 HydrophobicContact CD2-CB 4.46Å; L165-P173 HydrophobicContact CD2-CG 4.37Å; L165-I175 HydrophobicContact CD1-CD1 3.9Å
166	S	96.4	Very high	96	Very high	86 Å²	86	74.7 Å²	74.7	60%	0.601	38%	0.378	S	S	*	.	H	α-helix	trans	-64	-21.3	177.5	76.9	0	0	0	0	114.1	E162 K163 T164	E162-S166 WeakPolarHBondContact O-CB 3.47Å; E162-S166 PolarHBondContact O-N 2.95Å; K163-S166 PolarHBondContact O-N 3.39Å; K163-S166 PolarHBondContact O-OG 2.98Å; T164-S166 VanDerWaalsContact C-N 3.28Å; T164-S166 PolarHBondContact O-N 2.95Å
167	H	95.5	Very high	96.3	Very high	135 Å²	135	76 Å²	76	63%	0.625	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.8	176.7	-63	-57.2	0	0	0	113.3	K163 T164 L165	K163-H167 PolarHBondContact O-CD2 3.43Å; T164-H167 PolarHBondContact O-N 3.28Å; T164-H167 VanDerWaalsContact O-N 3.1Å; L165-H167 PolarHBondContact O-N 3.04Å
168	L	95.1	Very high	96.4	Very high	26 Å²	26	77 Å²	77	14%	0.136	38%	0.382	C	S	.	.			trans	-97.2	143.2	177.1	-56.6	-179.1	0	0	0	110.1	L129 Y139 T164 L165 N170	L129-L168 HydrophobicContact CB-CD1 4.49Å; Y139-L168 HydrophobicContact CE2-CD1 4.16Å; T164-L168 WeakPolarHBondContact O-CG 3.4Å; L165-L168 HydrophobicContact CD2-CD1 4.17Å; L165-L168 PolarHBondContact O-N 3.07Å; L165-L168 VanDerWaalsContact O-N 3.08Å; L168-N170 PolarHBondContact O-N 2.88Å
169	N	92.3	Very high	96.4	Very high	173 Å²	173	75.7 Å²	75.7	93%	0.925	38%	0.382	S	S	*	.	S	Bend	trans	-84.1	0.5	178.6	-67.3	-31	0	0	0	113
170	N	94	Very high	96.4	Very high	41 Å²	41	71.6 Å²	71.6	22%	0.219	36%	0.364	C	S	.	.	S	Bend	trans	-94.3	149.7	-174.2	-51.3	66	0	0	0	110.5	S133 Y139 L168	S133-N170 PolarHBondContact O-ND2 2.91Å; Y139-N170 HydrophobicContact CD1-CB 3.59Å; Y139-N170 HydrophobicContact CE1-CB 3.15Å; Y139-N170 HydrophobicContact CG-CB 4.44Å; L168-N170 PolarHBondContact O-N 2.88Å
171	K	94.9	Very high	96.5	Very high	190 Å²	190	70.3 Å²	70.3	83%	0.826	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-58.1	124.5	173.5	-179.3	-176.6	177.2	-176.2	0	110	Y139	Y139-K171 VanDerWaalsContact CE1-O 3.28Å; Y139-K171 WeakPolarHBondContact CE1-O 3.41Å
172	P	96.7	Very high	96.5	Very high	81 Å²	81	79.2 Å²	79.2	53%	0.526	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-61.9	139.7	-174.8	24.7	-34.3	0	0	0	111.9	L165	L165-P172 HydrophobicContact CD1-CB 4.03Å; L165-P172 HydrophobicContact CD2-CB 4.46Å
173	P	97.4	Very high	96.6	Very high	16 Å²	16	79.5 Å²	79.5	10%	0.104	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-68.7	161.4	173	32.1	-36.7	0	0	0	110.8	L129 L142 I144 L165	L129-P173 HydrophobicContact CD2-CG 4.12Å; L142-P173 HydrophobicContact CB-CB 4.21Å; L142-P173 HydrophobicContact CD2-CB 4.28Å; L142-P173 HydrophobicContact CD2-CG 4.18Å; L142-P173 HydrophobicContact CG-CB 4.21Å; L142-P173 WeakPolarHBondContact O-CB 3.35Å; I144-P173 HydrophobicContact CD1-CG 3.79Å; I144-P173 HydrophobicContact CG1-CB 4.41Å; I144-P173 HydrophobicContact CG1-CG 4Å; L165-P173 HydrophobicContact CD2-CG 4.37Å
174	L	97.8	Very high	96.7	Very high	121 Å²	121	73 Å²	73	63%	0.634	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	141.6	169.8	-63.2	176.3	0	0	0	109.8	I144 F176	I144-L174 PolarHBondContact N-O 3.32Å; L174-F176 HydrophobicContact CB-CD2 4.47Å; L174-F176 HydrophobicContact CB-CE2 3.58Å; L174-F176 HydrophobicContact CB-CZ 3.88Å; L174-F176 HydrophobicContact CD1-CE2 4.35Å; L174-F176 HydrophobicContact CD1-CZ 4.05Å
175	I	98.2	Very high	96.7	Very high	38 Å²	38	75.2 Å²	75.2	20%	0.195	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.4	-179.9	-45.7	179.4	0	0	0	109.1	I144 I161 L165 W177	I144-I175 HydrophobicContact CB-CB 4.46Å; I144-I175 HydrophobicContact CB-CG1 4.32Å; I144-I175 HydrophobicContact CB-CG2 4.15Å; I144-I175 HydrophobicContact CD1-CD1 4.38Å; I144-I175 HydrophobicContact CD1-CG1 4.11Å; I144-I175 HydrophobicContact CG2-CG2 4.21Å; I144-I175 CarbonylContact O-C 3.49Å; I144-I175 WeakPolarHBondContact O-CA 3.36Å; I161-I175 HydrophobicContact CG2-CD1 3.62Å; L165-I175 HydrophobicContact CD1-CD1 3.9Å; I175-W177 HydrophobicContact CB-CH2 4.11Å; I175-W177 HydrophobicContact CB-CZ3 4Å; I175-W177 HydrophobicContact CG2-CE3 4.15Å; I175-W177 HydrophobicContact CG2-CH2 3.43Å; I175-W177 VanDerWaalsContact CG2-CH2 3.43Å; I175-W177 HydrophobicContact CG2-CZ2 3.91Å; I175-W177 HydrophobicContact CG2-CZ3 3.56Å
176	F	98.3	Very high	96.8	Very high	85 Å²	85	79.2 Å²	79.2	37%	0.373	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.4	179.5	-56.6	-84.2	0	0	0	110.3	I144 H145 L146 L174 H178	I144-F176 PolarHBondContact O-N 3.46Å; H145-F176 WeakPolarHBondContact CA-O 3.31Å; H145-F176 AromaticContact CE1-CD2 3.53Å; H145-F176 AromaticContact NE2-CD2 3.74Å; L146-F176 PolarHBondContact N-O 3.17Å; L174-F176 HydrophobicContact CB-CD2 4.47Å; L174-F176 HydrophobicContact CB-CE2 3.58Å; L174-F176 HydrophobicContact CB-CZ 3.88Å; L174-F176 HydrophobicContact CD1-CE2 4.35Å; L174-F176 HydrophobicContact CD1-CZ 4.05Å; F176-H178 WeakPolarHBondContact CB-NE2 3.21Å
177	W	98.2	Very high	96.8	Very high	73 Å²	73	79.1 Å²	79.1	28%	0.277	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.6	171.3	-73.9	-93.4	0	0	0	110.2	L146 R154 K158 I175	L146-W177 HydrophobicContact CB-CG 4.39Å; L146-W177 HydrophobicContact CD1-CZ2 4.12Å; L146-W177 CarbonylContact O-C 3.6Å; L146-W177 WeakPolarHBondContact O-CA 3.42Å; R154-W177 HydrophobicContact CB-CG 4.4Å; R154-W177 VanDerWaalsContact CD-CD1 3.47Å; R154-W177 HydrophobicContact CG-CB 4.5Å; R154-W177 VanDerWaalsContact CG-CD1 3.4Å; R154-W177 HydrophobicContact CG-CG 4.04Å; K158-W177 HydrophobicContact CB-CH2 3.88Å; K158-W177 HydrophobicContact CB-CZ2 3.78Å; K158-W177 HydrophobicContact CD-CH2 4.45Å; K158-W177 HydrophobicContact CG-CH2 4.04Å; K158-W177 HydrophobicContact CG-CZ2 4.45Å; I175-W177 HydrophobicContact CB-CH2 4.11Å; I175-W177 HydrophobicContact CB-CZ3 4Å; I175-W177 HydrophobicContact CG2-CE3 4.15Å; I175-W177 HydrophobicContact CG2-CH2 3.43Å; I175-W177 VanDerWaalsContact CG2-CH2 3.43Å; I175-W177 HydrophobicContact CG2-CZ2 3.91Å; I175-W177 HydrophobicContact CG2-CZ3 3.56Å
178	H	97.9	Very high	97	Very high	21 Å²	21	73.8 Å²	73.8	10%	0.097	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.4	-179.9	-54.6	-80.8	0	0	0	108.3	H145 L146 V147 E148 F176 Q183 V184	H145-H178 AromaticContact CG-NE2 3.83Å; H145-H178 AromaticContact ND1-CD2 3.95Å; H145-H178 AromaticContact ND1-CE1 3.82Å; H145-H178 AromaticContact ND1-NE2 3.04Å; H145-H178 PolarHBondContact ND1-NE2 2.93Å; L146-H178 PolarHBondContact O-N 3.07Å; V147-H178 CarbonylContact C-O 3.58Å; V147-H178 WeakPolarHBondContact CA-O 3.46Å; V147-H178 HydrophobicContact CG2-CB 4.34Å; E148-H178 PolarHBondContact N-O 3.31Å; F176-H178 WeakPolarHBondContact CB-NE2 3.21Å; H178-Q183 HydrophobicContact CB-CB 4.18Å; H178-V184 HydrophobicContact CB-CG2 4.29Å
179	T	94.5	Very high	97.2	Very high	66 Å²	66	72.6 Å²	72.6	41%	0.405	36%	0.357	S	S	.	.	S	Bend	trans	-90.2	-11.5	171.3	57.7	0	0	0	0	111.9	Q183	T179-Q183 PolarHBondContact OG1-NE2 3.41Å; T179-Q183 PolarHBondContact OG1-OE1 3.01Å
180	D	96	Very high	97.5	Very high	47 Å²	47	64.3 Å²	64.3	25%	0.251	31%	0.313	S	S	.	.	S	Bend	trans	-152.1	141.7	-175.7	-169	-77.6	0	0	0	111	R182 Q183	D180-R182 PolarHBondContact O-N 3.44Å; D180-R182 VanDerWaalsContact O-N 3.15Å; D180-R182 WeakPolarHBondContact OD1-CB 3.27Å; D180-R182 VanDerWaalsContact OD1-CG 3.28Å; D180-R182 WeakPolarHBondContact OD1-CG 3.47Å; D180-R182 IonicContact OD1-CZ 3.42Å; D180-R182 PolarHBondContact OD1-N 3.21Å; D180-R182 IonicContact OD1-NE 3.37Å; D180-R182 PolarHBondContact OD1-NE 3.26Å; D180-R182 IonicContact OD1-NH2 2.64Å; D180-R182 IonicContact OD2-CZ 3.73Å; D180-R182 IonicContact OD2-NE 3.2Å; D180-R182 PolarHBondContact OD2-NE 3.04Å; D180-R182 IonicContact OD2-NH2 2.78Å; D180-R182 PolarHBondContact OD2-NH2 2.9Å; D180-Q183 HydrophobicContact CB-CG 4.32Å; D180-Q183 WeakPolarHBondContact O-CB 3.43Å; D180-Q183 PolarHBondContact O-N 3.12Å
181	L	97.8	Very high	97.7	Very high	8 Å²	8	62.4 Å²	62.4	4%	0.042	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-56.1	-30.7	178.7	176.6	56.9	0	0	0	113.1	V115 L117 Q183 V184 F191 V263 L266 L267 R270	V115-L181 HydrophobicContact CG1-CD1 4.11Å; L117-L181 HydrophobicContact CD2-CB 4.36Å; L117-L181 HydrophobicContact CD2-CD1 4.11Å; L117-L181 HydrophobicContact CD2-CD2 4.43Å; L181-Q183 PolarHBondContact O-N 3Å; L181-V184 HydrophobicContact CD1-CG2 4.24Å; L181-V184 WeakPolarHBondContact O-CB 3.36Å; L181-V184 PolarHBondContact O-N 2.93Å; L181-V184 VanDerWaalsContact O-N 3.16Å; L181-F191 HydrophobicContact CD1-CD1 3.93Å; L181-F191 HydrophobicContact CD1-CE1 3.73Å; L181-V263 HydrophobicContact CD2-CG1 4.22Å; L181-L266 HydrophobicContact CB-CD2 4.4Å; L181-L266 HydrophobicContact CD2-CD2 3.89Å; L181-L266 HydrophobicContact CD2-CG 4.24Å; L181-L266 HydrophobicContact CG-CD2 3.99Å; L181-L267 HydrophobicContact CD2-CD2 3.73Å; L181-L267 HydrophobicContact CD2-CG 4.16Å; L181-R270 PolarHBondContact O-NH1 2.93Å
182	R	97.8	Very high	97.9	Very high	187 Å²	187	53.4 Å²	53.4	71%	0.706	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-67.2	-18.8	178.3	-63.9	167.9	-74.5	-171.2	-3.7	113.3	D180 L266	D180-R182 PolarHBondContact O-N 3.44Å; D180-R182 VanDerWaalsContact O-N 3.15Å; D180-R182 WeakPolarHBondContact OD1-CB 3.27Å; D180-R182 VanDerWaalsContact OD1-CG 3.28Å; D180-R182 WeakPolarHBondContact OD1-CG 3.47Å; D180-R182 IonicContact OD1-CZ 3.42Å; D180-R182 PolarHBondContact OD1-N 3.21Å; D180-R182 IonicContact OD1-NE 3.37Å; D180-R182 PolarHBondContact OD1-NE 3.26Å; D180-R182 IonicContact OD1-NH2 2.64Å; D180-R182 IonicContact OD2-CZ 3.73Å; D180-R182 IonicContact OD2-NE 3.2Å; D180-R182 PolarHBondContact OD2-NE 3.04Å; D180-R182 IonicContact OD2-NH2 2.78Å; D180-R182 PolarHBondContact OD2-NH2 2.9Å; R182-L266 HydrophobicContact CG-CD2 3.73Å
183	Q	98.4	Very high	98	Very high	103 Å²	103	49.6 Å²	49.6	48%	0.481	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-81.5	-18.9	176.1	-62.8	171.5	-12.6	0	0	112.4	H178 T179 D180 L181	H178-Q183 HydrophobicContact CB-CB 4.18Å; T179-Q183 PolarHBondContact OG1-NE2 3.41Å; T179-Q183 PolarHBondContact OG1-OE1 3.01Å; D180-Q183 HydrophobicContact CB-CG 4.32Å; D180-Q183 WeakPolarHBondContact O-CB 3.43Å; D180-Q183 PolarHBondContact O-N 3.12Å; L181-Q183 PolarHBondContact O-N 3Å
184	V	98.6	Very high	97.9	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	24%	0.238	C	C	.	.	S	Bend	trans	-66.7	126.2	176.9	-178.2	0	0	0	0	108.5	V115 H145 V147 H178 L181 R270	V115-V184 HydrophobicContact CG1-CG1 4.39Å; V115-V184 HydrophobicContact CG1-CG2 4.08Å; V115-V184 HydrophobicContact CG2-CG1 3.86Å; H145-V184 HydrophobicContact CB-CG1 4.18Å; H145-V184 HydrophobicContact CB-CG2 4.48Å; V147-V184 HydrophobicContact CG2-CG2 3.97Å; H178-V184 HydrophobicContact CB-CG2 4.29Å; L181-V184 HydrophobicContact CD1-CG2 4.24Å; L181-V184 WeakPolarHBondContact O-CB 3.36Å; L181-V184 PolarHBondContact O-N 2.93Å; L181-V184 VanDerWaalsContact O-N 3.16Å; V184-R270 PolarHBondContact O-NH1 2.86Å
185	P	98.4	Very high	97.8	Very high	61 Å²	61	45.5 Å²	45.5	40%	0.396	22%	0.216	S	C	.	.			trans	-54.6	143.6	179	-25.5	33.3	0	0	0	112.1	Q113 N187 R270	Q113-P185 PolarHBondContact NE2-O 2.96Å; Q113-P185 PolarHBondContact OE1-O 2.93Å; P185-N187 PolarHBondContact O-N 2.93Å; P185-N187 VanDerWaalsContact O-N 3.1Å; P185-R270 PolarHBondContact O-NH2 2.93Å
186	E	97.7	Very high	97.7	Very high	104 Å²	104	45.4 Å²	45.4	49%	0.486	21%	0.214	S	C	.	.	S	Bend	trans	-80.8	85.1	-179.8	-64.8	-174.8	171.9	0	0	111.8	K273 T274	E186-K273 WeakPolarHBondContact OE2-CE 3.34Å; E186-K273 IonicContact OE2-NZ 3.85Å; E186-K273 PolarHBondContact OE2-NZ 3.27Å; E186-T274 HydrophobicContact CB-CG2 4.48Å
187	N	98.1	Very high	97.7	Very high	84 Å²	84	41.7 Å²	41.7	45%	0.449	20%	0.197	S	C	.	.	S	Bend	trans	-131.1	179.2	168.5	-53.2	-68	0	0	0	110.8	Q113 P185 S189 T274	Q113-N187 HydrophobicContact CG-CB 4.45Å; Q113-N187 PolarHBondContact OE1-O 3.02Å; P185-N187 PolarHBondContact O-N 2.93Å; P185-N187 VanDerWaalsContact O-N 3.1Å; N187-S189 PolarHBondContact O-N 3.31Å; N187-S189 VanDerWaalsContact O-N 3.1Å; N187-S189 PolarHBondContact O-OG 2.82Å; N187-T274 PolarHBondContact O-OG1 2.93Å
188	F	98.6	Very high	97.6	Very high	24 Å²	24	38.6 Å²	38.6	11%	0.105	19%	0.186	C	C	.	.	S	Bend	trans	-50.9	118.3	172.3	-173.1	-82.7	0	0	0	110.6	Q106 P109 L112 Q113 F190 T274	Q106-F188 HydrophobicContact CB-CE2 3.87Å; Q106-F188 HydrophobicContact CB-CZ 3.86Å; Q106-F188 HydrophobicContact CG-CE2 4.43Å; Q106-F188 HydrophobicContact CG-CZ 4.37Å; P109-F188 HydrophobicContact CB-CB 4.49Å; P109-F188 HydrophobicContact CB-CD1 4.03Å; P109-F188 HydrophobicContact CB-CD2 4.14Å; P109-F188 HydrophobicContact CB-CE1 4.33Å; P109-F188 HydrophobicContact CB-CE2 4.4Å; P109-F188 HydrophobicContact CB-CG 3.95Å; P109-F188 HydrophobicContact CG-CD1 4.01Å; P109-F188 HydrophobicContact CG-CD2 3.7Å; P109-F188 HydrophobicContact CG-CE1 3.87Å; P109-F188 HydrophobicContact CG-CE2 3.51Å; P109-F188 HydrophobicContact CG-CG 3.95Å; P109-F188 HydrophobicContact CG-CZ 3.63Å; L112-F188 HydrophobicContact CD1-CD1 3.84Å; L112-F188 HydrophobicContact CD1-CE1 3.85Å; Q113-F188 PolarHBondContact N-O 3.34Å; F188-F190 HydrophobicContact CE1-CD1 4.33Å; F188-F190 AromaticContact CE1-CE1 3.74Å; F188-F190 HydrophobicContact CE1-CE1 3.74Å; F188-F190 AromaticContact CE1-CZ 3.84Å; F188-F190 HydrophobicContact CE1-CZ 3.84Å; F188-F190 AromaticContact CZ-CE1 3.85Å; F188-F190 HydrophobicContact CZ-CE1 3.85Å; F188-F190 HydrophobicContact CZ-CZ 4.11Å; F188-T274 WeakPolarHBondContact CA-O 3.42Å
189	S	98.8	Very high	97.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135.6	-167.6	-62.8	0	0	0	0	111.7	Q113 N187 F191 G276 S277	Q113-S189 CarbonylContact O-C 3.56Å; Q113-S189 VanDerWaalsContact O-CA 3.26Å; Q113-S189 WeakPolarHBondContact O-CA 3.43Å; Q113-S189 PolarHBondContact OE1-OG 2.79Å; N187-S189 PolarHBondContact O-N 3.31Å; N187-S189 VanDerWaalsContact O-N 3.1Å; N187-S189 PolarHBondContact O-OG 2.82Å; S189-F191 VanDerWaalsContact CB-CE2 3.44Å; S189-G276 CarbonylContact O-C 3.49Å; S189-G276 WeakPolarHBondContact O-CA 3.44Å; S189-S277 PolarHBondContact O-N 3.22Å; S189-S277 VanDerWaalsContact O-N 3.16Å
190	F	98.9	Very high	97.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.8	159.3	-65.6	-33.8	0	0	0	110.3	L99 E102 W103 L112 Q113 L114 V115 F188 S277	L99-F190 HydrophobicContact CB-CD2 4.06Å; L99-F190 HydrophobicContact CB-CE2 4.19Å; L99-F190 HydrophobicContact CD2-CB 3.67Å; L99-F190 HydrophobicContact CD2-CD1 4.37Å; L99-F190 HydrophobicContact CD2-CD2 3.62Å; L99-F190 HydrophobicContact CD2-CE2 4.33Å; L99-F190 HydrophobicContact CD2-CG 3.65Å; L99-F190 HydrophobicContact CG-CD2 4.34Å; L99-F190 VanDerWaalsContact O-CE2 3.26Å; L99-F190 WeakPolarHBondContact O-CE2 3.48Å; E102-F190 HydrophobicContact CB-CE1 4.04Å; E102-F190 HydrophobicContact CB-CZ 3.89Å; W103-F190 HydrophobicContact CB-CE2 3.83Å; W103-F190 HydrophobicContact CB-CZ 3.8Å; L112-F190 HydrophobicContact CD1-CB 4.29Å; L112-F190 HydrophobicContact CD1-CD1 4.42Å; L112-F190 HydrophobicContact CD1-CD2 3.39Å; L112-F190 HydrophobicContact CD1-CE2 3.73Å; L112-F190 HydrophobicContact CD1-CG 3.77Å; L112-F190 HydrophobicContact CD1-CZ 4.35Å; L112-F190 HydrophobicContact CD2-CD2 3.88Å; L112-F190 HydrophobicContact CD2-CE2 3.85Å; L112-F190 HydrophobicContact CG-CD2 4.25Å; L112-F190 HydrophobicContact CG-CE2 4.47Å; Q113-F190 PolarHBondContact O-N 3.02Å; L114-F190 HydrophobicContact CD1-CB 4.28Å; V115-F190 WeakPolarHBondContact CA-O 3.4Å; V115-F190 WeakPolarHBondContact CB-O 3.41Å; V115-F190 PolarHBondContact N-O 3.11Å; F188-F190 HydrophobicContact CE1-CD1 4.33Å; F188-F190 AromaticContact CE1-CE1 3.74Å; F188-F190 HydrophobicContact CE1-CE1 3.74Å; F188-F190 AromaticContact CE1-CZ 3.84Å; F188-F190 HydrophobicContact CE1-CZ 3.84Å; F188-F190 AromaticContact CZ-CE1 3.85Å; F188-F190 HydrophobicContact CZ-CE1 3.85Å; F188-F190 HydrophobicContact CZ-CZ 4.11Å; F190-S277 CarbonylContact C-O 3.58Å; F190-S277 VanDerWaalsContact CA-O 3.29Å; F190-S277 WeakPolarHBondContact CA-O 3.44Å
191	F	98.9	Very high	97.7	Very high	1 Å²	1	35.5 Å²	35.5	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.5	177.9	-53.7	-86.1	0	0	0	109.7	V115 L181 S189 L267 R270 I271 S277 A278 L279	V115-F191 HydrophobicContact CB-CD1 3.56Å; V115-F191 HydrophobicContact CB-CE1 3.95Å; V115-F191 HydrophobicContact CB-CG 4.4Å; V115-F191 HydrophobicContact CG1-CD1 3.74Å; V115-F191 HydrophobicContact CG1-CE1 4.06Å; V115-F191 HydrophobicContact CG2-CD1 3.92Å; V115-F191 HydrophobicContact CG2-CE1 3.78Å; V115-F191 CarbonylContact O-C 3.53Å; V115-F191 VanDerWaalsContact O-CA 3.27Å; V115-F191 WeakPolarHBondContact O-CA 3.36Å; L181-F191 HydrophobicContact CD1-CD1 3.93Å; L181-F191 HydrophobicContact CD1-CE1 3.73Å; S189-F191 VanDerWaalsContact CB-CE2 3.44Å; F191-L267 HydrophobicContact CB-CD2 3.6Å; F191-L267 HydrophobicContact CD1-CD2 3.47Å; F191-L267 VanDerWaalsContact CD1-CD2 3.47Å; F191-L267 HydrophobicContact CD2-CD2 3.7Å; F191-L267 HydrophobicContact CE1-CD2 4.05Å; F191-L267 HydrophobicContact CE2-CD2 4.23Å; F191-L267 HydrophobicContact CG-CD2 3.28Å; F191-L267 HydrophobicContact CZ-CD2 4.4Å; F191-R270 HydrophobicContact CE2-CB 4.29Å; F191-R270 HydrophobicContact CZ-CB 4.11Å; F191-R270 VanDerWaalsContact CZ-NE 3.27Å; F191-I271 HydrophobicContact CD2-CG1 4.35Å; F191-I271 HydrophobicContact CE2-CG1 4.19Å; F191-S277 PolarHBondContact N-O 3.43Å; F191-A278 HydrophobicContact CB-CB 3.99Å; F191-A278 CarbonylContact O-C 3.56Å; F191-A278 VanDerWaalsContact O-CA 3.23Å; F191-A278 WeakPolarHBondContact O-CA 3.27Å; F191-L279 PolarHBondContact O-N 3.11Å
192	I	98.8	Very high	97.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.2	170.3	-62.1	165.9	0	0	0	108.4	I95 L99 L114 V115 E116 L117 L124 I128 H194 L279	I95-I192 HydrophobicContact CG2-CD1 3.89Å; L99-I192 HydrophobicContact CD1-CD1 3.9Å; L114-I192 HydrophobicContact CD1-CD1 4.05Å; V115-I192 PolarHBondContact O-N 3.31Å; E116-I192 HydrophobicContact CG-CB 4.49Å; L117-I192 PolarHBondContact N-O 3.08Å; L124-I192 HydrophobicContact CD2-CG2 3.82Å; I128-I192 HydrophobicContact CD1-CD1 3.39Å; I192-H194 HydrophobicContact CG2-CB 4.45Å; I192-L279 WeakPolarHBondContact CA-O 3.31Å
193	G	98.2	Very high	97.8	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	116.9	162.5	0	0	0	0	0	108.1	L279 L280 I281	G193-L279 PolarHBondContact N-O 3.43Å; G193-L280 CarbonylContact O-C 3.5Å; G193-L280 WeakPolarHBondContact O-CA 3.5Å; G193-I281 PolarHBondContact O-N 2.96Å
194	H	97	Very high	97.7	Very high	16 Å²	16	23.2 Å²	23.2	7%	0.074	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	111.4	178.9	176.4	-84	0	0	0	108.9	P85 F91 L124 I192 F196 I281	P85-H194 VanDerWaalsContact CD-CE1 3.45Å; P85-H194 WeakPolarHBondContact CD-CE1 3.19Å; F91-H194 AromaticContact CE1-CD2 3.7Å; F91-H194 AromaticContact CE1-NE2 3.74Å; F91-H194 AromaticContact CZ-CD2 3.46Å; F91-H194 VanDerWaalsContact CZ-CD2 3.46Å; F91-H194 WeakPolarHBondContact CZ-CD2 3.09Å; F91-H194 AromaticContact CZ-NE2 3.44Å; F91-H194 WeakPolarHBondContact CZ-NE2 3.27Å; L124-H194 HydrophobicContact CD2-CB 4.12Å; I192-H194 HydrophobicContact CG2-CB 4.45Å; H194-F196 VanDerWaalsContact C-N 3.32Å; H194-I281 CarbonylContact C-O 3.59Å; H194-I281 VanDerWaalsContact CA-O 3.31Å; H194-I281 WeakPolarHBondContact CA-O 3.17Å
195	E	95.3	Very high	97.7	Very high	36 Å²	36	23.3 Å²	23.3	17%	0.168	12%	0.12	C	C	.	.	S	Bend	trans	53.3	52.8	-170.9	-61	-178.6	-99.8	0	0	110.3	T83 I281 D282 Y283 F387	T83-E195 VanDerWaalsContact CB-OE1 3.23Å; T83-E195 WeakPolarHBondContact CB-OE1 3.31Å; T83-E195 VanDerWaalsContact CG2-OE1 3.23Å; T83-E195 WeakPolarHBondContact CG2-OE1 3.3Å; E195-I281 PolarHBondContact N-O 3.27Å; E195-D282 WeakPolarHBondContact CA-OD2 3.3Å; E195-Y283 HydrophobicContact CG-CD1 4.46Å; E195-F387 HydrophobicContact CG-CE1 3.61Å; E195-F387 HydrophobicContact CG-CZ 4.26Å
196	F	96.4	Very high	97.6	Very high	36 Å²	36	24.6 Å²	24.6	16%	0.158	12%	0.12	C	C	.	.			trans	-109.9	-32	-177	175	-102.6	0	0	0	111.8	L117 H194 L200 V263 D282	L117-F196 HydrophobicContact CB-CB 4.49Å; L117-F196 HydrophobicContact CB-CD1 3.98Å; L117-F196 HydrophobicContact CB-CD2 3.69Å; L117-F196 HydrophobicContact CB-CE1 4.13Å; L117-F196 HydrophobicContact CB-CE2 3.84Å; L117-F196 HydrophobicContact CB-CG 3.76Å; L117-F196 HydrophobicContact CB-CZ 4.06Å; L117-F196 HydrophobicContact CD1-CD1 4.08Å; L117-F196 HydrophobicContact CD1-CE1 3.98Å; L117-F196 HydrophobicContact CD1-CZ 4.48Å; H194-F196 VanDerWaalsContact C-N 3.32Å; F196-L200 HydrophobicContact CE1-CD1 4.08Å; F196-L200 HydrophobicContact CZ-CD2 4.45Å; F196-L200 WeakPolarHBondContact O-CG 3.27Å; F196-V263 HydrophobicContact CE1-CG1 4.47Å; F196-D282 PolarHBondContact N-OD2 3.21Å
197	F	98	Very high	97.5	Very high	6 Å²	6	22.4 Å²	22.4	3%	0.026	11%	0.109	C	C	.	.	S	Bend	trans	-92	-27.5	-171.7	-68	-56.4	0	0	0	112.7	V199 L200 M260 V263 L280 D282 V317 L322	F197-V199 PolarHBondContact O-N 2.78Å; F197-L200 HydrophobicContact CD1-CD1 3.7Å; F197-L200 HydrophobicContact CE1-CD1 4.38Å; F197-L200 WeakPolarHBondContact O-CB 3.41Å; F197-L200 PolarHBondContact O-N 3.18Å; F197-L200 VanDerWaalsContact O-N 3.08Å; F197-M260 HydrophobicContact CB-CG 4.35Å; F197-M260 HydrophobicContact CB-SD 4.4Å; F197-M260 HydrophobicContact CD1-CB 3.77Å; F197-M260 HydrophobicContact CD1-CG 3.67Å; F197-M260 HydrophobicContact CD2-CG 4.31Å; F197-M260 HydrophobicContact CE1-CB 4.19Å; F197-M260 HydrophobicContact CE1-CG 3.95Å; F197-M260 HydrophobicContact CG-CB 4.32Å; F197-M260 HydrophobicContact CG-CG 3.87Å; F197-M260 HydrophobicContact CG-SD 4.41Å; F197-M260 HydrophobicContact CZ-CG 4.38Å; F197-V263 HydrophobicContact CE1-CB 4.05Å; F197-V263 HydrophobicContact CE1-CG1 3.87Å; F197-V263 HydrophobicContact CZ-CG1 4.06Å; F197-L280 HydrophobicContact CE2-CB 4.15Å; F197-L280 HydrophobicContact CE2-CD1 3.94Å; F197-L280 HydrophobicContact CE2-CD2 3.84Å; F197-L280 HydrophobicContact CE2-CG 4.17Å; F197-L280 HydrophobicContact CZ-CD1 4.25Å; F197-L280 HydrophobicContact CZ-CD2 4.09Å; F197-D282 PolarHBondContact N-OD2 3.36Å; F197-V317 HydrophobicContact CB-CG2 3.68Å; F197-L322 HydrophobicContact CE2-CD1 4.29Å
198	D	96.3	Very high	97.3	Very high	8 Å²	8	21.9 Å²	21.9	4%	0.043	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-29.4	-176.7	73.6	-55.6	0	0	0	113.4	D282 Y283 T314 C315 V317	D198-D282 WeakPolarHBondContact CB-OD1 3.49Å; D198-D282 PolarHBondContact N-OD2 3.3Å; D198-Y283 HydrophobicContact CB-CE1 4.04Å; D198-Y283 HydrophobicContact CB-CE2 4.23Å; D198-Y283 WeakPolarHBondContact OD2-CE1 3.11Å; D198-Y283 PolarHBondContact OD2-OH 3.18Å; D198-T314 WeakPolarHBondContact CB-OG1 3.38Å; D198-T314 WeakPolarHBondContact O-CA 3.42Å; D198-T314 PolarHBondContact O-OG1 3.4Å; D198-T314 PolarHBondContact OD2-OG1 3.25Å; D198-C315 WeakPolarHBondContact CA-O 3.36Å; D198-C315 VanDerWaalsContact CB-O 3.29Å; D198-C315 WeakPolarHBondContact CB-O 3.46Å; D198-C315 PolarHBondContact O-N 3.15Å; D198-V317 HydrophobicContact CB-CG2 4.35Å
199	V	95.2	Very high	97	Very high	26 Å²	26	28.8 Å²	28.8	16%	0.158	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-4.6	179.2	-61.5	0	0	0	0	113.1	L61 Y69 F197	L61-V199 HydrophobicContact CD1-CB 4.23Å; L61-V199 WeakPolarHBondContact CD1-O 3.31Å; Y69-V199 HydrophobicContact CE2-CB 4.31Å; Y69-V199 HydrophobicContact CE2-CG1 4.49Å; Y69-V199 WeakPolarHBondContact OH-CG1 3.45Å; F197-V199 PolarHBondContact O-N 2.78Å
200	L	96.8	Very high	96.6	Very high	26 Å²	26	31.6 Å²	31.6	14%	0.136	17%	0.165	C	C	.	.	S	Bend	trans	-74.5	143.8	177.7	-63.7	-172.1	0	0	0	110.9	M57 F196 F197 V202 C257 D259	M57-L200 WeakPolarHBondContact CE-O 3.42Å; F196-L200 HydrophobicContact CE1-CD1 4.08Å; F196-L200 HydrophobicContact CZ-CD2 4.45Å; F196-L200 WeakPolarHBondContact O-CG 3.27Å; F197-L200 HydrophobicContact CD1-CD1 3.7Å; F197-L200 HydrophobicContact CE1-CD1 4.38Å; F197-L200 WeakPolarHBondContact O-CB 3.41Å; F197-L200 PolarHBondContact O-N 3.18Å; F197-L200 VanDerWaalsContact O-N 3.08Å; L200-V202 WeakPolarHBondContact O-CG1 3.46Å; L200-V202 PolarHBondContact O-N 3.3Å; L200-C257 WeakPolarHBondContact CB-SG 3.33Å; L200-D259 HydrophobicContact CD1-CB 3.94Å
201	P	97.8	Very high	96.5	Very high	18 Å²	18	38.4 Å²	38.4	12%	0.117	20%	0.195	C	C	.	.			trans	-54	127.4	-178.9	-30.1	37.8	0	0	0	114.2	S54 K58	S54-P201 WeakPolarHBondContact O-CB 3.27Å; S54-P201 VanDerWaalsContact OG-CB 3.26Å; S54-P201 WeakPolarHBondContact OG-CB 3.47Å; K58-P201 HydrophobicContact CB-CG 3.89Å; K58-P201 HydrophobicContact CG-CG 4.46Å
202	V	98.3	Very high	96.4	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.024	20%	0.204	C	C	.	.			trans	-114	145.7	178.8	-50.5	0	0	0	0	112.9	V53 S54 M57 L200 R204 E255 V256 C257 C315	V53-V202 CarbonylContact C-O 3.59Å; V53-V202 HydrophobicContact CG1-CG2 4.44Å; S54-V202 VanDerWaalsContact CA-O 3.24Å; S54-V202 WeakPolarHBondContact CA-O 3.22Å; S54-V202 WeakPolarHBondContact CB-O 3.44Å; S54-V202 PolarHBondContact N-O 2.93Å; M57-V202 HydrophobicContact SD-CB 4.38Å; M57-V202 HydrophobicContact SD-CG2 3.7Å; L200-V202 WeakPolarHBondContact O-CG1 3.46Å; L200-V202 PolarHBondContact O-N 3.3Å; V202-R204 HydrophobicContact CG2-CG 4.16Å; V202-E255 HydrophobicContact CG2-CG 4.37Å; V202-V256 WeakPolarHBondContact CA-O 3.29Å; V202-C257 HydrophobicContact CG1-CB 3.94Å; V202-C315 HydrophobicContact CG1-CB 3.91Å; V202-C315 HydrophobicContact CG2-CB 4.14Å
203	H	98.5	Very high	96.3	Very high	15 Å²	15	42.4 Å²	42.4	7%	0.069	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.6	163.2	-69.2	-92.7	0	0	0	109.2	S54 F205 E214 A237 Y241 V256	S54-H203 WeakPolarHBondContact CB-NE2 3.43Å; S54-H203 PolarHBondContact OG-NE2 2.9Å; H203-F205 HydrophobicContact CB-CE2 3.62Å; H203-F205 HydrophobicContact CB-CZ 3.69Å; H203-E214 IonicContact CE1-OE1 3.66Å; H203-E214 IonicContact CG-OE1 3.72Å; H203-E214 IonicContact ND1-OE1 2.73Å; H203-E214 PolarHBondContact ND1-OE1 2.71Å; H203-A237 WeakPolarHBondContact ND1-CB 3.5Å; H203-Y241 HydrophobicContact CB-CD2 4.35Å; H203-Y241 AromaticContact CD2-CD2 3.74Å; H203-Y241 AromaticContact CD2-CE2 3.48Å; H203-Y241 VanDerWaalsContact CD2-CE2 3.48Å; H203-Y241 WeakPolarHBondContact CD2-CE2 3.09Å; H203-Y241 AromaticContact CG-CD2 3.94Å; H203-Y241 AromaticContact NE2-CE2 3.55Å; H203-V256 PolarHBondContact N-O 2.84Å; H203-V256 PolarHBondContact O-N 3.38Å
204	R	97.7	Very high	96.3	Very high	21 Å²	21	42.4 Å²	42.4	8%	0.079	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.1	178.8	-75.9	176.2	76.5	-140.9	-3.4	109.4	V53 V202 E214 V215 E255 D291	V53-R204 HydrophobicContact CB-CG 4.45Å; V53-R204 HydrophobicContact CG1-CG 4.28Å; V53-R204 HydrophobicContact CG2-CB 4.36Å; V53-R204 HydrophobicContact CG2-CG 4.49Å; V202-R204 HydrophobicContact CG2-CG 4.16Å; R204-E214 CarbonylContact O-C 3.45Å; R204-E214 WeakPolarHBondContact O-CA 3.44Å; R204-E214 WeakPolarHBondContact O-CG 3.37Å; R204-V215 HydrophobicContact CB-CB 3.82Å; R204-V215 HydrophobicContact CB-CG2 4.25Å; R204-V215 PolarHBondContact O-N 2.74Å; R204-E255 HydrophobicContact CG-CG 3.61Å; R204-E255 IonicContact NE-OE1 2.91Å; R204-E255 PolarHBondContact NE-OE1 2.96Å; R204-D291 IonicContact CZ-OD1 2.62Å; R204-D291 IonicContact NE-OD1 3.4Å; R204-D291 IonicContact NH2-OD1 3.74Å; R204-D291 PolarHBondContact NH2-OD1 2.93Å; R204-D291 IonicContact NH2-OD2 3.45Å; R204-D291 PolarHBondContact NH2-OD2 3.27Å; R204-D291 VanDerWaalsContact NH2-OD2 3.13Å
205	F	98.1	Very high	96.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.6	175.4	-54.7	-81.8	0	0	0	110.1	H203 W212 H213 E214 A237 S238 L242 S253 V254 V256	H203-F205 HydrophobicContact CB-CE2 3.62Å; H203-F205 HydrophobicContact CB-CZ 3.69Å; F205-W212 HydrophobicContact CB-CE3 3.83Å; F205-W212 HydrophobicContact CB-CZ3 4.22Å; F205-H213 CarbonylContact C-O 3.55Å; F205-H213 VanDerWaalsContact CA-O 3.25Å; F205-H213 WeakPolarHBondContact CA-O 3.4Å; F205-E214 HydrophobicContact CD1-CB 3.88Å; F205-E214 HydrophobicContact CD1-CG 4.1Å; F205-E214 HydrophobicContact CE1-CB 3.81Å; F205-E214 HydrophobicContact CE1-CG 3.78Å; F205-A237 HydrophobicContact CZ-CB 4.18Å; F205-S238 VanDerWaalsContact CE1-CA 3.4Å; F205-L242 HydrophobicContact CB-CD2 3.92Å; F205-L242 HydrophobicContact CD1-CD1 4.34Å; F205-L242 HydrophobicContact CD1-CD2 4.33Å; F205-L242 HydrophobicContact CD1-CG 4.31Å; F205-L242 HydrophobicContact CD2-CD2 3.74Å; F205-L242 HydrophobicContact CD2-CG 4.26Å; F205-L242 HydrophobicContact CE2-CD2 4.33Å; F205-L242 HydrophobicContact CE2-CG 4.44Å; F205-L242 HydrophobicContact CG-CD2 3.72Å; F205-L242 HydrophobicContact CG-CG 4.18Å; F205-S253 CarbonylContact O-C 3.58Å; F205-S253 WeakPolarHBondContact O-CA 3.35Å; F205-S253 WeakPolarHBondContact O-CB 3.46Å; F205-V254 HydrophobicContact CB-CG1 3.91Å; F205-V254 HydrophobicContact CD2-CG1 4.1Å; F205-V254 HydrophobicContact CG-CG1 4.47Å; F205-V254 PolarHBondContact N-O 3.06Å; F205-V254 PolarHBondContact O-N 3.28Å; F205-V256 HydrophobicContact CD2-CG2 4.19Å; F205-V256 HydrophobicContact CE2-CB 4.35Å; F205-V256 HydrophobicContact CE2-CG2 4.08Å
206	Q	96.9	Very high	96.6	Very high	88 Å²	88	41.4 Å²	41.4	41%	0.411	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.2	176.9	-167.5	178.8	25	0	0	110.1	H213 V215	Q206-H213 PolarHBondContact N-O 3.24Å; Q206-H213 PolarHBondContact O-N 3.25Å; Q206-V215 HydrophobicContact CB-CG2 4.01Å
207	K	95.3	Very high	96.6	Very high	59 Å²	59	39.7 Å²	39.7	26%	0.257	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.2	176.4	-158.6	176.3	-175	179.4	0	109.7	K211 W212 D252	K207-K211 CarbonylContact C-O 3.53Å; K207-K211 VanDerWaalsContact CA-O 3.27Å; K207-K211 WeakPolarHBondContact CA-O 3.38Å; K207-W212 HydrophobicContact CB-CD2 4.28Å; K207-W212 HydrophobicContact CB-CE3 4.14Å; K207-W212 HydrophobicContact CB-CH2 4.26Å; K207-W212 HydrophobicContact CB-CZ2 4.37Å; K207-W212 HydrophobicContact CB-CZ3 4.14Å; K207-W212 HydrophobicContact CD-CZ2 4.2Å; K207-W212 HydrophobicContact CG-CD2 4.48Å; K207-D252 WeakPolarHBondContact CB-O 3.06Å; K207-D252 PolarHBondContact N-O 2.83Å
208	H	93.7	Very high	96.6	Very high	72 Å²	72	40.3 Å²	40.3	33%	0.333	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	130.3	174.1	-174.3	63.2	0	0	0	109	G210 K211 R230	H208-G210 PolarHBondContact O-N 3.03Å; H208-G210 VanDerWaalsContact O-N 3.11Å; H208-K211 PolarHBondContact N-O 2.86Å; H208-K211 PolarHBondContact O-N 2.8Å; H208-R230 VanDerWaalsContact CB-NH1 3.27Å; H208-R230 PolarHBondContact CD2-NH1 2.62Å; H208-R230 PolarHBondContact CE1-NH1 2.81Å; H208-R230 PolarHBondContact ND1-NH1 3.19Å; H208-R230 PolarHBondContact NE2-NH1 2.83Å; H208-R230 PolarHBondContact NE2-NH2 3.01Å
209	E	91.5	Very high	96.6	Very high	169 Å²	169	41.2 Å²	41.2	79%	0.79	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	38.5	-177.6	-57.7	-176.4	162.4	0	0	112.8	K211	E209-K211 VanDerWaalsContact C-N 3.26Å; E209-K211 PolarHBondContact O-N 2.84Å
210	G	92	Very high	96.4	Very high	59 Å²	59	45.3 Å²	45.3	61%	0.608	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.6	0.5	-179.9	0	0	0	0	0	115.6	H208	H208-G210 PolarHBondContact O-N 3.03Å; H208-G210 VanDerWaalsContact O-N 3.11Å
211	K	95.2	Very high	95.7	Very high	143 Å²	143	52.3 Å²	52.3	62%	0.622	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	144.3	179.2	-65.5	176.6	-175.7	169.2	0	111.4	K207 H208 E209 H213	K207-K211 CarbonylContact C-O 3.53Å; K207-K211 VanDerWaalsContact CA-O 3.27Å; K207-K211 WeakPolarHBondContact CA-O 3.38Å; H208-K211 PolarHBondContact N-O 2.86Å; H208-K211 PolarHBondContact O-N 2.8Å; E209-K211 VanDerWaalsContact C-N 3.26Å; E209-K211 PolarHBondContact O-N 2.84Å; K211-H213 PolarHBondContact O-CD2 3.2Å; K211-H213 VanDerWaalsContact O-CD2 3.29Å
212	W	96.9	Very high	94.9	Very high	49 Å²	49	59.9 Å²	59.9	19%	0.186	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.8	173.8	-71.6	103.1	0	0	0	110.8	F205 K207 L242 L248 R251 V254	F205-W212 HydrophobicContact CB-CE3 3.83Å; F205-W212 HydrophobicContact CB-CZ3 4.22Å; K207-W212 HydrophobicContact CB-CD2 4.28Å; K207-W212 HydrophobicContact CB-CE3 4.14Å; K207-W212 HydrophobicContact CB-CH2 4.26Å; K207-W212 HydrophobicContact CB-CZ2 4.37Å; K207-W212 HydrophobicContact CB-CZ3 4.14Å; K207-W212 HydrophobicContact CD-CZ2 4.2Å; K207-W212 HydrophobicContact CG-CD2 4.48Å; W212-L242 HydrophobicContact CB-CD1 3.56Å; W212-L242 HydrophobicContact CD2-CD2 4.31Å; W212-L242 HydrophobicContact CE3-CD2 4.39Å; W212-L242 HydrophobicContact CG-CD1 3.87Å; W212-L242 HydrophobicContact CG-CD2 4.48Å; W212-L248 HydrophobicContact CH2-CD2 4.18Å; W212-L248 HydrophobicContact CZ2-CB 4.21Å; W212-L248 HydrophobicContact CZ2-CD2 3.77Å; W212-R251 HydrophobicContact CH2-CB 4.08Å; W212-R251 WeakPolarHBondContact CH2-O 3.38Å; W212-R251 HydrophobicContact CZ2-CB 4.42Å; W212-R251 WeakPolarHBondContact CZ2-O 3.37Å; W212-V254 HydrophobicContact CH2-CG1 4.17Å; W212-V254 HydrophobicContact CZ3-CG1 3.9Å
213	H	97.9	Very high	94.2	Very high	36 Å²	36	61.6 Å²	61.6	17%	0.167	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	141.5	175.3	-63.2	-94.3	0	0	0	109.1	F205 Q206 K211 R230 S231	F205-H213 CarbonylContact C-O 3.55Å; F205-H213 VanDerWaalsContact CA-O 3.25Å; F205-H213 WeakPolarHBondContact CA-O 3.4Å; Q206-H213 PolarHBondContact N-O 3.24Å; Q206-H213 PolarHBondContact O-N 3.25Å; K211-H213 PolarHBondContact O-CD2 3.2Å; K211-H213 VanDerWaalsContact O-CD2 3.29Å; H213-R230 HydrophobicContact CB-CB 4.05Å; H213-S231 PolarHBondContact ND1-O 2.83Å
214	E	98.4	Very high	93.7	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.009	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	136.7	170.9	-169.1	172.6	-173.9	0	0	109.5	T52 H203 R204 F205 L216 R230 S231 T235	T52-E214 VanDerWaalsContact CG2-OE1 3.3Å; T52-E214 WeakPolarHBondContact CG2-OE1 3.31Å; H203-E214 IonicContact CE1-OE1 3.66Å; H203-E214 IonicContact CG-OE1 3.72Å; H203-E214 IonicContact ND1-OE1 2.73Å; H203-E214 PolarHBondContact ND1-OE1 2.71Å; R204-E214 CarbonylContact O-C 3.45Å; R204-E214 WeakPolarHBondContact O-CA 3.44Å; R204-E214 WeakPolarHBondContact O-CG 3.37Å; F205-E214 HydrophobicContact CD1-CB 3.88Å; F205-E214 HydrophobicContact CD1-CG 4.1Å; F205-E214 HydrophobicContact CE1-CB 3.81Å; F205-E214 HydrophobicContact CE1-CG 3.78Å; E214-L216 HydrophobicContact CB-CD2 4.26Å; E214-L216 HydrophobicContact CG-CD2 3.77Å; E214-R230 CarbonylContact O-C 3.55Å; E214-R230 WeakPolarHBondContact O-CA 3.25Å; E214-S231 PolarHBondContact N-OG 2.65Å; E214-S231 PolarHBondContact O-N 2.74Å; E214-T235 HydrophobicContact CB-CG2 3.98Å; E214-T235 WeakPolarHBondContact OE2-CB 3.2Å; E214-T235 WeakPolarHBondContact OE2-CG2 3.27Å; E214-T235 PolarHBondContact OE2-OG1 3.41Å
215	V	98.4	Very high	93.5	Very high	9 Å²	9	69.1 Å²	69.1	6%	0.055	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	126	170.7	-178.4	0	0	0	0	108	V53 R204 Q206 F228 V229	V53-V215 HydrophobicContact CG2-CG1 4.41Å; V53-V215 WeakPolarHBondContact CG2-O 3.28Å; R204-V215 HydrophobicContact CB-CB 3.82Å; R204-V215 HydrophobicContact CB-CG2 4.25Å; R204-V215 PolarHBondContact O-N 2.74Å; Q206-V215 HydrophobicContact CB-CG2 4.01Å; V215-F228 HydrophobicContact CG1-CB 4.01Å; V215-F228 HydrophobicContact CG1-CD1 3.78Å; V215-F228 HydrophobicContact CG1-CG 4.13Å; V215-V229 WeakPolarHBondContact CA-O 3.46Å
216	L	98.5	Very high	93.5	Very high	21 Å²	21	69.8 Å²	69.8	11%	0.11	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	158.5	-175.2	-53.5	175.5	0	0	0	109.7	P50 L51 T52 E214 F228 V229	P50-L216 HydrophobicContact CB-CB 3.8Å; P50-L216 HydrophobicContact CB-CD1 4.04Å; L51-L216 CarbonylContact O-C 3.45Å; L51-L216 WeakPolarHBondContact O-CA 3.36Å; L51-L216 VanDerWaalsContact O-CB 3.3Å; L51-L216 WeakPolarHBondContact O-CB 3.23Å; T52-L216 HydrophobicContact CG2-CD2 3.99Å; E214-L216 HydrophobicContact CB-CD2 4.26Å; E214-L216 HydrophobicContact CG-CD2 3.77Å; L216-F228 CarbonylContact O-C 3.56Å; L216-F228 VanDerWaalsContact O-CA 3.31Å; L216-F228 WeakPolarHBondContact O-CA 3.4Å; L216-V229 HydrophobicContact CB-CG2 3.92Å; L216-V229 PolarHBondContact N-O 2.81Å; L216-V229 PolarHBondContact O-N 3Å
217	V	98.3	Very high	93.5	Very high	0 Å²	0	67 Å²	67	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	122.2	173.7	-176.4	0	0	0	0	109.1	I45 P50 L51 V53 Y56 L226 C227 F228 L305	I45-V217 HydrophobicContact CD1-CG1 4.4Å; P50-V217 CarbonylContact C-O 3.49Å; P50-V217 WeakPolarHBondContact CA-O 3.29Å; L51-V217 PolarHBondContact N-O 2.88Å; L51-V217 PolarHBondContact O-N 3.39Å; V53-V217 HydrophobicContact CG2-CG2 4.13Å; Y56-V217 HydrophobicContact CD1-CG2 4.31Å; Y56-V217 HydrophobicContact CD2-CG1 4.09Å; Y56-V217 HydrophobicContact CD2-CG2 4.38Å; Y56-V217 HydrophobicContact CE2-CG1 4.47Å; Y56-V217 HydrophobicContact CG-CB 4.5Å; Y56-V217 HydrophobicContact CG-CG1 4.46Å; Y56-V217 HydrophobicContact CG-CG2 3.93Å; V217-L226 HydrophobicContact CG1-CB 4.16Å; V217-L226 HydrophobicContact CG1-CD1 4.41Å; V217-L226 HydrophobicContact CG1-CD2 4.05Å; V217-L226 HydrophobicContact CG1-CG 4.44Å; V217-C227 WeakPolarHBondContact CA-O 3.43Å; V217-F228 HydrophobicContact CG2-CD1 4.2Å; V217-F228 HydrophobicContact CG2-CE1 3.99Å; V217-L305 HydrophobicContact CG1-CD2 3.9Å; V217-L305 HydrophobicContact CG2-CD2 4.09Å
218	S	97.5	Very high	93.6	Very high	20 Å²	20	67.9 Å²	67.9	14%	0.14	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	171.5	-178.5	-169.6	0	0	0	0	111.2	L226 C227	S218-L226 CarbonylContact O-C 3.52Å; S218-L226 VanDerWaalsContact O-CA 3.28Å; S218-L226 WeakPolarHBondContact O-CA 3.47Å; S218-C227 PolarHBondContact N-O 2.91Å; S218-C227 PolarHBondContact O-N 3.3Å
219	S	95.5	Very high	93.7	Very high	27 Å²	27	66.7 Å²	66.7	19%	0.189	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	139.1	166.4	55.1	0	0	0	0	110	N46	N46-S219 PolarHBondContact OD1-OG 2.79Å
220	M	92	Very high	94	Very high	111 Å²	111	64 Å²	64	55%	0.547	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-74.2	135.9	168	-120.9	-165.2	179.7	0	0	109.2	N222 S223 S225 C227	M220-N222 PolarHBondContact O-N 3.05Å; M220-S223 WeakPolarHBondContact CB-OG 3.26Å; M220-S223 PolarHBondContact O-N 2.84Å; M220-S223 VanDerWaalsContact O-N 3.17Å; M220-S223 PolarHBondContact O-OG 2.82Å; M220-S223 VanDerWaalsContact O-OG 3.13Å; M220-S225 PolarHBondContact N-O 3.16Å; M220-C227 HydrophobicContact CG-CB 4.18Å
221	M	81.8	Confident	94.3	Very high	174 Å²	174	61.6 Å²	61.6	86%	0.857	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	132.5	178.6	-61.2	-177.6	93	0	0	111.4	S223	M221-S223 PolarHBondContact O-N 2.9Å
222	N	80.4	Confident	94.2	Very high	177 Å²	177	58.4 Å²	58.4	95%	0.947	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	24.5	178.1	-52.9	-37.1	0	0	0	114.9	M220	M220-N222 PolarHBondContact O-N 3.05Å
223	S	84.2	Confident	94	Very high	39 Å²	39	61.3 Å²	61.3	27%	0.273	35%	0.347	S	S	.	.	S	Bend	trans	-136.1	158.3	174.5	82	0	0	0	0	111.1	M220 M221 S225	M220-S223 WeakPolarHBondContact CB-OG 3.26Å; M220-S223 PolarHBondContact O-N 2.84Å; M220-S223 VanDerWaalsContact O-N 3.17Å; M220-S223 PolarHBondContact O-OG 2.82Å; M220-S223 VanDerWaalsContact O-OG 3.13Å; M221-S223 PolarHBondContact O-N 2.9Å; S223-S225 PolarHBondContact O-N 2.84Å; S223-S225 WeakPolarHBondContact OG-CB 2.97Å; S223-S225 PolarHBondContact OG-N 2.91Å
224	N	86.6	Confident	93.9	Very high	137 Å²	137	67.5 Å²	67.5	73%	0.733	37%	0.373	S	S	*	.	S	Bend	trans	-90.6	32.5	168.9	-69.2	-18	0	0	0	111.5	K38 L42	K38-N224 VanDerWaalsContact CE-O 3.25Å; K38-N224 WeakPolarHBondContact CE-O 3.39Å; L42-N224 HydrophobicContact CD1-CB 4.2Å
225	S	94.4	Very high	93.8	Very high	57 Å²	57	68.3 Å²	68.3	40%	0.399	38%	0.378	S	S	.	.			trans	-109.9	143.8	-178.4	-61.9	0	0	0	0	111.1	M220 S223	M220-S225 PolarHBondContact N-O 3.16Å; S223-S225 PolarHBondContact O-N 2.84Å; S223-S225 WeakPolarHBondContact OG-CB 2.97Å; S223-S225 PolarHBondContact OG-N 2.91Å
226	L	97.4	Very high	93.8	Very high	17 Å²	17	72.9 Å²	72.9	9%	0.089	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	151	171.1	-64	170.3	0	0	0	109.8	L42 I45 Y56 V217 S218 L305 P308	L42-L226 HydrophobicContact CD2-CD2 3.64Å; L42-L226 HydrophobicContact CD2-CG 4.33Å; L42-L226 HydrophobicContact CG-CD2 4.13Å; I45-L226 HydrophobicContact CD1-CD2 3.59Å; Y56-L226 HydrophobicContact CE2-CD1 3.67Å; V217-L226 HydrophobicContact CG1-CB 4.16Å; V217-L226 HydrophobicContact CG1-CD1 4.41Å; V217-L226 HydrophobicContact CG1-CD2 4.05Å; V217-L226 HydrophobicContact CG1-CG 4.44Å; S218-L226 CarbonylContact O-C 3.52Å; S218-L226 VanDerWaalsContact O-CA 3.28Å; S218-L226 WeakPolarHBondContact O-CA 3.47Å; L226-L305 HydrophobicContact CB-CB 4.08Å; L226-L305 HydrophobicContact CB-CD1 4.23Å; L226-L305 HydrophobicContact CB-CD2 4.46Å; L226-L305 HydrophobicContact CB-CG 4.5Å; L226-P308 HydrophobicContact CD1-CG 3.94Å
227	C	97.1	Very high	93.7	Very high	30 Å²	30	72.5 Å²	72.5	20%	0.203	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159.9	174.8	64.6	0	0	0	0	111.5	V217 S218 M220	V217-C227 WeakPolarHBondContact CA-O 3.43Å; S218-C227 PolarHBondContact N-O 2.91Å; S218-C227 PolarHBondContact O-N 3.3Å; M220-C227 HydrophobicContact CG-CB 4.18Å
228	F	97.6	Very high	93.7	Very high	76 Å²	76	72.9 Å²	72.9	33%	0.333	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	137.3	170.4	-65.1	-64.5	0	0	0	111.3	V53 V215 L216 V217 F293 P304 L305	V53-F228 HydrophobicContact CG2-CD1 4.37Å; V53-F228 HydrophobicContact CG2-CE1 4.04Å; V215-F228 HydrophobicContact CG1-CB 4.01Å; V215-F228 HydrophobicContact CG1-CD1 3.78Å; V215-F228 HydrophobicContact CG1-CG 4.13Å; L216-F228 CarbonylContact O-C 3.56Å; L216-F228 VanDerWaalsContact O-CA 3.31Å; L216-F228 WeakPolarHBondContact O-CA 3.4Å; V217-F228 HydrophobicContact CG2-CD1 4.2Å; V217-F228 HydrophobicContact CG2-CE1 3.99Å; F228-F293 HydrophobicContact CE1-CD1 4.39Å; F228-F293 HydrophobicContact CE1-CE1 4.21Å; F228-F293 AromaticContact CZ-CD1 3.93Å; F228-F293 HydrophobicContact CZ-CD1 3.93Å; F228-F293 AromaticContact CZ-CE1 3.85Å; F228-F293 HydrophobicContact CZ-CE1 3.85Å; F228-P304 HydrophobicContact CE2-CG 4.34Å; F228-P304 HydrophobicContact CZ-CG 3.99Å; F228-L305 HydrophobicContact CD1-CD1 4.29Å; F228-L305 HydrophobicContact CD2-CD1 3.92Å; F228-L305 HydrophobicContact CE1-CD1 4.13Å; F228-L305 HydrophobicContact CE1-CD2 4.09Å; F228-L305 HydrophobicContact CE1-CG 4.33Å; F228-L305 HydrophobicContact CE2-CD1 3.75Å; F228-L305 HydrophobicContact CE2-CG 4.02Å; F228-L305 HydrophobicContact CG-CD1 4.19Å; F228-L305 HydrophobicContact CZ-CD1 3.86Å; F228-L305 HydrophobicContact CZ-CD2 3.96Å; F228-L305 HydrophobicContact CZ-CG 3.83Å
229	V	97.1	Very high	93.7	Very high	48 Å²	48	76.9 Å²	76.9	29%	0.291	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	161.6	171.9	-60.2	0	0	0	0	110	P50 V215 L216	P50-V229 HydrophobicContact CB-CG2 4.14Å; P50-V229 HydrophobicContact CG-CG2 4.14Å; V215-V229 WeakPolarHBondContact CA-O 3.46Å; L216-V229 HydrophobicContact CB-CG2 3.92Å; L216-V229 PolarHBondContact N-O 2.81Å; L216-V229 PolarHBondContact O-N 3Å
230	R	97.3	Very high	93.8	Very high	112 Å²	112	79.6 Å²	79.6	42%	0.423	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.7	175.3	-65.9	175.7	-60.9	175.5	9.7	109.8	H208 H213 E214 G232	H208-R230 VanDerWaalsContact CB-NH1 3.27Å; H208-R230 PolarHBondContact CD2-NH1 2.62Å; H208-R230 PolarHBondContact CE1-NH1 2.81Å; H208-R230 PolarHBondContact ND1-NH1 3.19Å; H208-R230 PolarHBondContact NE2-NH1 2.83Å; H208-R230 PolarHBondContact NE2-NH2 3.01Å; H213-R230 HydrophobicContact CB-CB 4.05Å; E214-R230 CarbonylContact O-C 3.55Å; E214-R230 WeakPolarHBondContact O-CA 3.25Å; R230-G232 PolarHBondContact O-N 2.64Å
231	S	97.4	Very high	94	Very high	9 Å²	9	77.2 Å²	77.2	6%	0.063	43%	0.43	C	S	.	.			trans	-60.7	134.9	175.2	72.3	0	0	0	0	110.8	H213 E214 T233	H213-S231 PolarHBondContact ND1-O 2.83Å; E214-S231 PolarHBondContact N-OG 2.65Å; E214-S231 PolarHBondContact O-N 2.74Å; S231-T233 VanDerWaalsContact C-N 3.26Å; S231-T233 WeakPolarHBondContact CB-O 3.29Å; S231-T233 PolarHBondContact O-N 3.1Å; S231-T233 PolarHBondContact OG-O 2.8Å
232	G	93.7	Very high	94.8	Very high	76 Å²	76	69.7 Å²	69.7	78%	0.784	39%	0.393	S	S	*	.	S	Bend	trans	-73.6	-18.7	176.6	0	0	0	0	0	113.6	R230	R230-G232 PolarHBondContact O-N 2.64Å
233	T	93.4	Very high	95.5	Very high	110 Å²	110	65.7 Å²	65.7	68%	0.675	38%	0.377	S	S	*	.	S	Bend	trans	-138.3	172.3	-177.7	57.8	0	0	0	0	110.7	S231 T235	S231-T233 VanDerWaalsContact C-N 3.26Å; S231-T233 WeakPolarHBondContact CB-O 3.29Å; S231-T233 PolarHBondContact O-N 3.1Å; S231-T233 PolarHBondContact OG-O 2.8Å; T233-T235 PolarHBondContact O-N 2.97Å
234	K	94.9	Very high	96.1	Very high	165 Å²	165	67.1 Å²	67.1	72%	0.717	38%	0.381	S	S	*	.			trans	-63.1	127.5	169.7	-68.6	-172.3	179	-175.3	0	109.5	I239	K234-I239 HydrophobicContact CB-CD1 4.39Å; K234-I239 HydrophobicContact CB-CG1 4.31Å; K234-I239 HydrophobicContact CD-CG1 4.46Å
235	T	97.2	Very high	96.6	Very high	19 Å²	19	61.1 Å²	61.1	12%	0.117	35%	0.35	C	S	.	.			trans	-91.3	160.1	173.3	64.8	0	0	0	0	110.5	E214 T233 A237 S238 I239	E214-T235 HydrophobicContact CB-CG2 3.98Å; E214-T235 WeakPolarHBondContact OE2-CB 3.2Å; E214-T235 WeakPolarHBondContact OE2-CG2 3.27Å; E214-T235 PolarHBondContact OE2-OG1 3.41Å; T233-T235 PolarHBondContact O-N 2.97Å; T235-A237 PolarHBondContact O-N 2.79Å; T235-S238 PolarHBondContact N-OG 3.46Å; T235-S238 PolarHBondContact O-N 2.9Å; T235-S238 VanDerWaalsContact O-N 3.12Å; T235-S238 PolarHBondContact O-OG 3.14Å; T235-S238 WeakPolarHBondContact OG1-CB 3.47Å; T235-S238 PolarHBondContact OG1-N 2.72Å; T235-S238 PolarHBondContact OG1-OG 3.1Å; T235-I239 WeakPolarHBondContact O-CG1 3.48Å; T235-I239 PolarHBondContact O-N 2.88Å; T235-I239 VanDerWaalsContact O-N 3.15Å
236	P	97.1	Very high	96.6	Very high	106 Å²	106	61.2 Å²	61.2	69%	0.688	35%	0.349	S	S	*	.	H	α-helix	trans	-53.2	-42.2	171.8	-27.1	35.9	0	0	0	112.7	S238 I239 V240	P236-S238 PolarHBondContact O-N 2.99Å; P236-I239 PolarHBondContact O-N 3.46Å; P236-V240 WeakPolarHBondContact O-CG2 3.08Å; P236-V240 PolarHBondContact O-N 3.13Å; P236-V240 VanDerWaalsContact O-N 3.08Å
237	A	97.2	Very high	96.4	Very high	12 Å²	12	63.7 Å²	63.7	10%	0.099	36%	0.362	C	S	.	.	H	α-helix	trans	-60.5	-44.3	176.7	0	0	0	0	0	112	H203 F205 T235 I239 V240 Y241	H203-A237 WeakPolarHBondContact ND1-CB 3.5Å; F205-A237 HydrophobicContact CZ-CB 4.18Å; T235-A237 PolarHBondContact O-N 2.79Å; A237-I239 VanDerWaalsContact C-N 3.26Å; A237-I239 PolarHBondContact O-N 3.24Å; A237-V240 PolarHBondContact O-N 2.99Å; A237-Y241 HydrophobicContact CB-CD2 3.72Å; A237-Y241 HydrophobicContact CB-CE2 3.82Å; A237-Y241 WeakPolarHBondContact O-CB 3.26Å; A237-Y241 WeakPolarHBondContact O-CD2 3.3Å; A237-Y241 PolarHBondContact O-N 3.14Å
238	S	97	Very high	96.2	Very high	8 Å²	8	64.2 Å²	64.2	6%	0.056	36%	0.362	C	S	.	.	H	α-helix	trans	-62.8	-32.2	177.2	73.5	0	0	0	0	113.2	F205 T235 P236 L242	F205-S238 VanDerWaalsContact CE1-CA 3.4Å; T235-S238 PolarHBondContact N-OG 3.46Å; T235-S238 PolarHBondContact O-N 2.9Å; T235-S238 VanDerWaalsContact O-N 3.12Å; T235-S238 PolarHBondContact O-OG 3.14Å; T235-S238 WeakPolarHBondContact OG1-CB 3.47Å; T235-S238 PolarHBondContact OG1-N 2.72Å; T235-S238 PolarHBondContact OG1-OG 3.1Å; P236-S238 PolarHBondContact O-N 2.99Å; S238-L242 WeakPolarHBondContact O-CB 3.44Å; S238-L242 WeakPolarHBondContact O-CD1 3.01Å; S238-L242 WeakPolarHBondContact O-CG 3.37Å
239	I	97.4	Very high	96	Very high	104 Å²	104	64.5 Å²	64.5	53%	0.533	37%	0.374	S	S	.	.	H	α-helix	trans	-73.9	-38.9	179.4	-66.6	166.7	0	0	0	110.6	K234 T235 P236 A237 P243	K234-I239 HydrophobicContact CB-CD1 4.39Å; K234-I239 HydrophobicContact CB-CG1 4.31Å; K234-I239 HydrophobicContact CD-CG1 4.46Å; T235-I239 WeakPolarHBondContact O-CG1 3.48Å; T235-I239 PolarHBondContact O-N 2.88Å; T235-I239 VanDerWaalsContact O-N 3.15Å; P236-I239 PolarHBondContact O-N 3.46Å; A237-I239 VanDerWaalsContact C-N 3.26Å; A237-I239 PolarHBondContact O-N 3.24Å; I239-P243 WeakPolarHBondContact O-CD 3.42Å; I239-P243 VanDerWaalsContact O-CG 3.3Å; I239-P243 WeakPolarHBondContact O-CG 3.4Å
240	V	97.7	Very high	95.6	Very high	85 Å²	85	68.8 Å²	68.8	52%	0.515	40%	0.395	S	S	.	.	H	α-helix	trans	-88.5	-41.1	-173.1	177.8	0	0	0	0	112.5	P236 A237	P236-V240 WeakPolarHBondContact O-CG2 3.08Å; P236-V240 PolarHBondContact O-N 3.13Å; P236-V240 VanDerWaalsContact O-N 3.08Å; A237-V240 PolarHBondContact O-N 2.99Å
241	Y	97.8	Very high	95.5	Very high	60 Å²	60	64.3 Å²	64.3	24%	0.235	38%	0.378	C	S	.	.	H	α-helix	trans	-94.4	-33	-167.8	-58.1	-40.6	0	0	0	114.5	H203 A237 L244 P258	H203-Y241 HydrophobicContact CB-CD2 4.35Å; H203-Y241 AromaticContact CD2-CD2 3.74Å; H203-Y241 AromaticContact CD2-CE2 3.48Å; H203-Y241 VanDerWaalsContact CD2-CE2 3.48Å; H203-Y241 WeakPolarHBondContact CD2-CE2 3.09Å; H203-Y241 AromaticContact CG-CD2 3.94Å; H203-Y241 AromaticContact NE2-CE2 3.55Å; A237-Y241 HydrophobicContact CB-CD2 3.72Å; A237-Y241 HydrophobicContact CB-CE2 3.82Å; A237-Y241 WeakPolarHBondContact O-CB 3.26Å; A237-Y241 WeakPolarHBondContact O-CD2 3.3Å; A237-Y241 PolarHBondContact O-N 3.14Å; Y241-L244 HydrophobicContact CD1-CD1 4.11Å; Y241-L244 WeakPolarHBondContact O-CB 3.47Å; Y241-L244 PolarHBondContact O-N 3.48Å; Y241-P258 HydrophobicContact CD1-CB 4.29Å; Y241-P258 HydrophobicContact CD1-CG 3.98Å; Y241-P258 HydrophobicContact CD2-CG 3.95Å; Y241-P258 HydrophobicContact CE1-CB 3.66Å; Y241-P258 HydrophobicContact CE1-CG 3.58Å; Y241-P258 HydrophobicContact CE2-CB 4.45Å; Y241-P258 HydrophobicContact CE2-CG 3.55Å; Y241-P258 HydrophobicContact CG-CG 4.17Å
242	L	97.1	Very high	95.4	Very high	17 Å²	17	69.4 Å²	69.4	9%	0.089	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-58.4	-40.9	175.8	-71.5	173	0	0	0	112.8	F205 W212 S238 L244 V245 L248 V254	F205-L242 HydrophobicContact CB-CD2 3.92Å; F205-L242 HydrophobicContact CD1-CD1 4.34Å; F205-L242 HydrophobicContact CD1-CD2 4.33Å; F205-L242 HydrophobicContact CD1-CG 4.31Å; F205-L242 HydrophobicContact CD2-CD2 3.74Å; F205-L242 HydrophobicContact CD2-CG 4.26Å; F205-L242 HydrophobicContact CE2-CD2 4.33Å; F205-L242 HydrophobicContact CE2-CG 4.44Å; F205-L242 HydrophobicContact CG-CD2 3.72Å; F205-L242 HydrophobicContact CG-CG 4.18Å; W212-L242 HydrophobicContact CB-CD1 3.56Å; W212-L242 HydrophobicContact CD2-CD2 4.31Å; W212-L242 HydrophobicContact CE3-CD2 4.39Å; W212-L242 HydrophobicContact CG-CD1 3.87Å; W212-L242 HydrophobicContact CG-CD2 4.48Å; S238-L242 WeakPolarHBondContact O-CB 3.44Å; S238-L242 WeakPolarHBondContact O-CD1 3.01Å; S238-L242 WeakPolarHBondContact O-CG 3.37Å; L242-L244 PolarHBondContact O-N 3.35Å; L242-L244 VanDerWaalsContact O-N 3.13Å; L242-V245 WeakPolarHBondContact O-CB 3.37Å; L242-V245 PolarHBondContact O-N 3.11Å; L242-V245 VanDerWaalsContact O-N 3.12Å; L242-L248 HydrophobicContact CB-CD1 4.12Å; L242-L248 HydrophobicContact CD2-CD1 4.31Å; L242-L248 HydrophobicContact CD2-CD2 4.17Å; L242-L248 WeakPolarHBondContact O-CD1 3.35Å; L242-V254 HydrophobicContact CD2-CG1 3.81Å
243	P	96.6	Very high	95.5	Very high	93 Å²	93	67.2 Å²	67.2	60%	0.604	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-62.3	-15.9	175.4	-25.2	36.4	0	0	0	115.3	I239 V245	I239-P243 WeakPolarHBondContact O-CD 3.42Å; I239-P243 VanDerWaalsContact O-CG 3.3Å; I239-P243 WeakPolarHBondContact O-CG 3.4Å; P243-V245 VanDerWaalsContact C-N 3.3Å
244	L	95.7	Very high	95.7	Very high	69 Å²	69	62 Å²	62	36%	0.361	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-83.7	-7.9	178.3	-54.3	178.3	0	0	0	112.7	Y241 L242 I261 H324	Y241-L244 HydrophobicContact CD1-CD1 4.11Å; Y241-L244 WeakPolarHBondContact O-CB 3.47Å; Y241-L244 PolarHBondContact O-N 3.48Å; L242-L244 PolarHBondContact O-N 3.35Å; L242-L244 VanDerWaalsContact O-N 3.13Å; L244-I261 HydrophobicContact CB-CD1 4.12Å; L244-I261 HydrophobicContact CD1-CD1 3.75Å; L244-H324 PolarHBondContact O-CD2 3.07Å
245	V	96.9	Very high	95.9	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.067	31%	0.314	C	S	.	.	S	Bend	trans	-85.1	122.5	178.6	-176	0	0	0	0	109.2	L242 P243 N247 L248 V254 V256 I321	L242-V245 WeakPolarHBondContact O-CB 3.37Å; L242-V245 PolarHBondContact O-N 3.11Å; L242-V245 VanDerWaalsContact O-N 3.12Å; P243-V245 VanDerWaalsContact C-N 3.3Å; V245-N247 VanDerWaalsContact C-N 3.31Å; V245-N247 PolarHBondContact O-N 3.32Å; V245-L248 HydrophobicContact CB-CD2 3.83Å; V245-L248 HydrophobicContact CB-CG 3.95Å; V245-L248 HydrophobicContact CG1-CD2 3.72Å; V245-L248 HydrophobicContact CG1-CG 4.03Å; V245-L248 HydrophobicContact CG2-CD2 4.18Å; V245-V254 HydrophobicContact CG1-CG2 4.19Å; V245-V254 HydrophobicContact CG2-CG2 4.01Å; V245-V256 HydrophobicContact CG2-CG2 3.66Å; V245-I321 HydrophobicContact CG1-CD1 4.34Å; V245-I321 HydrophobicContact CG1-CG1 4.35Å; V245-I321 HydrophobicContact CG2-CD1 3.94Å; V245-I321 HydrophobicContact CG2-CG1 4.47Å
246	P	94.5	Very high	95.9	Very high	58 Å²	58	53.8 Å²	53.8	38%	0.377	31%	0.308	S	S	.	.	S	Bend	trans	-64.4	-30.9	-172.2	23	-33.9	0	0	0	114.3	H324	P246-H324 HydrophobicContact CB-CB 4.2Å; P246-H324 HydrophobicContact CG-CB 4.07Å
247	N	93.2	Very high	96	Very high	70 Å²	70	49.1 Å²	49.1	37%	0.374	28%	0.278	S	S	.	.			trans	-144.9	109.7	177.4	-176.7	-5.2	0	0	0	111.2	V245 S249 R251	V245-N247 VanDerWaalsContact C-N 3.31Å; V245-N247 PolarHBondContact O-N 3.32Å; N247-S249 PolarHBondContact OD1-N 3.36Å; N247-S249 PolarHBondContact OD1-OG 2.95Å; N247-R251 VanDerWaalsContact O-CD 3.3Å; N247-R251 WeakPolarHBondContact O-CD 3.41Å; N247-R251 PolarHBondContact O-NE 2.84Å
248	L	94.5	Very high	96	Very high	40 Å²	40	49.1 Å²	49.1	21%	0.209	28%	0.277	C	S	.	.			trans	-100.7	-10.3	173.6	-71.7	172.5	0	0	0	113.8	W212 L242 V245 N250 R251 V254	W212-L248 HydrophobicContact CH2-CD2 4.18Å; W212-L248 HydrophobicContact CZ2-CB 4.21Å; W212-L248 HydrophobicContact CZ2-CD2 3.77Å; L242-L248 HydrophobicContact CB-CD1 4.12Å; L242-L248 HydrophobicContact CD2-CD1 4.31Å; L242-L248 HydrophobicContact CD2-CD2 4.17Å; L242-L248 WeakPolarHBondContact O-CD1 3.35Å; V245-L248 HydrophobicContact CB-CD2 3.83Å; V245-L248 HydrophobicContact CB-CG 3.95Å; V245-L248 HydrophobicContact CG1-CD2 3.72Å; V245-L248 HydrophobicContact CG1-CG 4.03Å; V245-L248 HydrophobicContact CG2-CD2 4.18Å; L248-N250 VanDerWaalsContact C-N 3.28Å; L248-N250 PolarHBondContact O-N 3.2Å; L248-R251 PolarHBondContact O-N 3.31Å; L248-V254 HydrophobicContact CD2-CG1 4.02Å
249	S	91.8	Very high	96	Very high	83 Å²	83	52.6 Å²	52.6	58%	0.58	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-34.1	-171.4	65.7	0	0	0	0	112.2	N247	N247-S249 PolarHBondContact OD1-N 3.36Å; N247-S249 PolarHBondContact OD1-OG 2.95Å
250	N	89.7	Confident	96.1	Very high	137 Å²	137	47.9 Å²	47.9	73%	0.733	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	18.5	-175.2	-58.9	-9.3	0	0	0	112.7	L248	L248-N250 VanDerWaalsContact C-N 3.28Å; L248-N250 PolarHBondContact O-N 3.2Å
251	R	94.7	Very high	96.1	Very high	19 Å²	19	44.4 Å²	44.4	7%	0.072	25%	0.25	C	C	.	.			trans	-125.3	139.5	-174.8	-60.6	-176.1	-175.9	-134.5	17.9	111.4	W212 N247 L248 G287 D318 S320	W212-R251 HydrophobicContact CH2-CB 4.08Å; W212-R251 WeakPolarHBondContact CH2-O 3.38Å; W212-R251 HydrophobicContact CZ2-CB 4.42Å; W212-R251 WeakPolarHBondContact CZ2-O 3.37Å; N247-R251 VanDerWaalsContact O-CD 3.3Å; N247-R251 WeakPolarHBondContact O-CD 3.41Å; N247-R251 PolarHBondContact O-NE 2.84Å; L248-R251 PolarHBondContact O-N 3.31Å; R251-G287 PolarHBondContact NH1-O 2.86Å; R251-D318 IonicContact CZ-OD2 2.68Å; R251-D318 IonicContact NH1-OD2 3.13Å; R251-D318 PolarHBondContact NH1-OD2 3.35Å; R251-D318 IonicContact NH2-OD1 3.56Å; R251-D318 IonicContact NH2-OD2 3.71Å; R251-D318 PolarHBondContact NH2-OD2 3.4Å; R251-S320 PolarHBondContact NH2-OG 2.8Å
252	D	95	Very high	96.1	Very high	116 Å²	116	45 Å²	45	62%	0.62	26%	0.262	S	S	*	.	S	Bend	trans	-106.5	-11.6	170.7	-68.3	-39.8	0	0	0	112.8	K207	K207-D252 WeakPolarHBondContact CB-O 3.06Å; K207-D252 PolarHBondContact N-O 2.83Å
253	S	96.7	Very high	96.2	Very high	29 Å²	29	45.5 Å²	45.5	20%	0.203	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.4	169.7	56.6	0	0	0	0	110.8	F205 G290	F205-S253 CarbonylContact O-C 3.58Å; F205-S253 WeakPolarHBondContact O-CA 3.35Å; F205-S253 WeakPolarHBondContact O-CB 3.46Å; S253-G290 WeakPolarHBondContact CB-O 3.32Å; S253-G290 WeakPolarHBondContact OG-CA 3.32Å; S253-G290 PolarHBondContact OG-O 3.45Å
254	V	97.6	Very high	96.3	Very high	1 Å²	1	41 Å²	41	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	139.9	178.1	63.1	0	0	0	0	110.8	F205 W212 L242 V245 L248 V256 I321	F205-V254 HydrophobicContact CB-CG1 3.91Å; F205-V254 HydrophobicContact CD2-CG1 4.1Å; F205-V254 HydrophobicContact CG-CG1 4.47Å; F205-V254 PolarHBondContact N-O 3.06Å; F205-V254 PolarHBondContact O-N 3.28Å; W212-V254 HydrophobicContact CH2-CG1 4.17Å; W212-V254 HydrophobicContact CZ3-CG1 3.9Å; L242-V254 HydrophobicContact CD2-CG1 3.81Å; V245-V254 HydrophobicContact CG1-CG2 4.19Å; V245-V254 HydrophobicContact CG2-CG2 4.01Å; L248-V254 HydrophobicContact CD2-CG1 4.02Å; V254-V256 HydrophobicContact CG1-CG2 4.41Å; V254-V256 HydrophobicContact CG2-CG2 3.99Å; V254-I321 HydrophobicContact CG2-CD1 4.18Å
255	E	98	Very high	96.4	Very high	11 Å²	11	40.4 Å²	40.4	5%	0.051	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.1	172.3	-79.7	151.3	170.3	0	0	108.2	V202 R204 T292 F293 C315	V202-E255 HydrophobicContact CG2-CG 4.37Å; R204-E255 HydrophobicContact CG-CG 3.61Å; R204-E255 IonicContact NE-OE1 2.91Å; R204-E255 PolarHBondContact NE-OE1 2.96Å; E255-T292 PolarHBondContact OE1-N 3Å; E255-T292 WeakPolarHBondContact OE2-CB 3.46Å; E255-T292 PolarHBondContact OE2-N 2.8Å; E255-T292 VanDerWaalsContact OE2-N 3.15Å; E255-T292 PolarHBondContact OE2-OG1 3.4Å; E255-F293 PolarHBondContact OE1-N 2.77Å; E255-C315 VanDerWaalsContact CB-SG 3.51Å; E255-C315 VanDerWaalsContact CG-SG 3.54Å; E255-C315 PolarHBondContact OE2-SG 3.19Å
256	V	98	Very high	96.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.9	-180	-171.6	0	0	0	0	109.1	V202 H203 F205 V245 V254 P258 I261 I321	V202-V256 WeakPolarHBondContact CA-O 3.29Å; H203-V256 PolarHBondContact N-O 2.84Å; H203-V256 PolarHBondContact O-N 3.38Å; F205-V256 HydrophobicContact CD2-CG2 4.19Å; F205-V256 HydrophobicContact CE2-CB 4.35Å; F205-V256 HydrophobicContact CE2-CG2 4.08Å; V245-V256 HydrophobicContact CG2-CG2 3.66Å; V254-V256 HydrophobicContact CG1-CG2 4.41Å; V254-V256 HydrophobicContact CG2-CG2 3.99Å; V256-P258 WeakPolarHBondContact O-CD 3.32Å; V256-I261 HydrophobicContact CG1-CD1 4.16Å; V256-I321 HydrophobicContact CG2-CD1 4.23Å
257	C	98.1	Very high	96.7	Very high	8 Å²	8	39.4 Å²	39.4	5%	0.054	22%	0.222	C	C	.	.			trans	-100.3	103.1	174.1	-175.7	0	0	0	0	110.4	L200 V202 D259 M260 I261	L200-C257 WeakPolarHBondContact CB-SG 3.33Å; V202-C257 HydrophobicContact CG1-CB 3.94Å; C257-D259 VanDerWaalsContact C-N 3.32Å; C257-D259 PolarHBondContact O-N 3.01Å; C257-M260 HydrophobicContact CB-CB 3.75Å; C257-M260 HydrophobicContact CB-CE 4.43Å; C257-M260 PolarHBondContact O-N 3.1Å; C257-M260 VanDerWaalsContact SG-CB 3.59Å; C257-M260 PolarHBondContact SG-N 2.9Å; C257-M260 VanDerWaalsContact SG-N 3.4Å; C257-I261 PolarHBondContact O-N 3.06Å
258	P	98.1	Very high	97	Very high	13 Å²	13	36 Å²	36	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-35.2	-179.8	-22.7	35.6	0	0	0	113.1	Y241 V256 I261 C262	Y241-P258 HydrophobicContact CD1-CB 4.29Å; Y241-P258 HydrophobicContact CD1-CG 3.98Å; Y241-P258 HydrophobicContact CD2-CG 3.95Å; Y241-P258 HydrophobicContact CE1-CB 3.66Å; Y241-P258 HydrophobicContact CE1-CG 3.58Å; Y241-P258 HydrophobicContact CE2-CB 4.45Å; Y241-P258 HydrophobicContact CE2-CG 3.55Å; Y241-P258 HydrophobicContact CG-CG 4.17Å; V256-P258 WeakPolarHBondContact O-CD 3.32Å; P258-I261 WeakPolarHBondContact O-CB 3.2Å; P258-I261 PolarHBondContact O-N 2.8Å; P258-C262 PolarHBondContact O-N 3.15Å; P258-C262 PolarHBondContact O-SG 3Å
259	D	97.6	Very high	97.2	Very high	81 Å²	81	39.9 Å²	39.9	43%	0.433	22%	0.219	S	C	.	.	H	α-helix	trans	-69.5	-36.6	-179.2	-74.7	-15	0	0	0	111.4	L200 C257 I261 C262 V263	L200-D259 HydrophobicContact CD1-CB 3.94Å; C257-D259 VanDerWaalsContact C-N 3.32Å; C257-D259 PolarHBondContact O-N 3.01Å; D259-I261 VanDerWaalsContact C-N 3.33Å; D259-I261 PolarHBondContact O-N 2.97Å; D259-C262 PolarHBondContact O-N 3.03Å; D259-V263 WeakPolarHBondContact O-CB 3.43Å; D259-V263 VanDerWaalsContact O-CG2 3.29Å; D259-V263 WeakPolarHBondContact O-CG2 3.44Å; D259-V263 PolarHBondContact O-N 3.02Å
260	M	98.5	Very high	97.5	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-46.2	171.2	177.9	-172.7	70.4	0	0	111.4	F197 C257 V263 A264 V317 I321 L322	F197-M260 HydrophobicContact CB-CG 4.35Å; F197-M260 HydrophobicContact CB-SD 4.4Å; F197-M260 HydrophobicContact CD1-CB 3.77Å; F197-M260 HydrophobicContact CD1-CG 3.67Å; F197-M260 HydrophobicContact CD2-CG 4.31Å; F197-M260 HydrophobicContact CE1-CB 4.19Å; F197-M260 HydrophobicContact CE1-CG 3.95Å; F197-M260 HydrophobicContact CG-CB 4.32Å; F197-M260 HydrophobicContact CG-CG 3.87Å; F197-M260 HydrophobicContact CG-SD 4.41Å; F197-M260 HydrophobicContact CZ-CG 4.38Å; C257-M260 HydrophobicContact CB-CB 3.75Å; C257-M260 HydrophobicContact CB-CE 4.43Å; C257-M260 PolarHBondContact O-N 3.1Å; C257-M260 VanDerWaalsContact SG-CB 3.59Å; C257-M260 PolarHBondContact SG-N 2.9Å; C257-M260 VanDerWaalsContact SG-N 3.4Å; M260-V263 PolarHBondContact O-N 3.07Å; M260-A264 VanDerWaalsContact O-CB 3.24Å; M260-A264 WeakPolarHBondContact O-CB 3.23Å; M260-A264 PolarHBondContact O-N 3.23Å; M260-V317 HydrophobicContact SD-CG1 3.7Å; M260-I321 HydrophobicContact CE-CB 4.13Å; M260-I321 HydrophobicContact CE-CG2 3.88Å; M260-L322 HydrophobicContact CE-CB 4.2Å; M260-L322 HydrophobicContact CG-CD1 3.69Å; M260-L322 HydrophobicContact SD-CB 4.03Å; M260-L322 HydrophobicContact SD-CD1 4.04Å
261	I	98.4	Very high	97.9	Very high	12 Å²	12	29.9 Å²	29.9	6%	0.062	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-48	177.4	-63.9	171.4	0	0	0	110.2	L244 V256 C257 P258 D259 A264 Q265 I321 A325	L244-I261 HydrophobicContact CB-CD1 4.12Å; L244-I261 HydrophobicContact CD1-CD1 3.75Å; V256-I261 HydrophobicContact CG1-CD1 4.16Å; C257-I261 PolarHBondContact O-N 3.06Å; P258-I261 WeakPolarHBondContact O-CB 3.2Å; P258-I261 PolarHBondContact O-N 2.8Å; D259-I261 VanDerWaalsContact C-N 3.33Å; D259-I261 PolarHBondContact O-N 2.97Å; I261-A264 PolarHBondContact O-N 2.99Å; I261-Q265 WeakPolarHBondContact O-CB 3.36Å; I261-Q265 WeakPolarHBondContact O-CG 3.04Å; I261-Q265 PolarHBondContact O-N 3.02Å; I261-I321 HydrophobicContact CD1-CG2 3.88Å; I261-I321 HydrophobicContact CG1-CG2 3.99Å; I261-A325 HydrophobicContact CB-CB 4.26Å; I261-A325 HydrophobicContact CG1-CB 4.24Å; I261-A325 HydrophobicContact CG2-CB 3.89Å
262	C	98.1	Very high	98	Very high	73 Å²	73	32.4 Å²	32.4	49%	0.493	17%	0.173	S	C	.	.	H	α-helix	trans	-61.4	-46.5	179.6	-67.7	0	0	0	0	112.3	P258 D259 Q265 L266	P258-C262 PolarHBondContact O-N 3.15Å; P258-C262 PolarHBondContact O-SG 3Å; D259-C262 PolarHBondContact O-N 3.03Å; C262-Q265 PolarHBondContact O-N 2.76Å; C262-L266 WeakPolarHBondContact O-CB 3.3Å; C262-L266 PolarHBondContact O-N 3.2Å
263	V	98.5	Very high	98.1	Very high	26 Å²	26	33.7 Å²	33.7	16%	0.158	17%	0.174	C	C	.	.	H	α-helix	trans	-64.7	-46.9	179.1	170	0	0	0	0	110.3	L117 L181 F196 F197 D259 M260 Q265 L266 L267	L117-V263 HydrophobicContact CD1-CG1 4.01Å; L181-V263 HydrophobicContact CD2-CG1 4.22Å; F196-V263 HydrophobicContact CE1-CG1 4.47Å; F197-V263 HydrophobicContact CE1-CB 4.05Å; F197-V263 HydrophobicContact CE1-CG1 3.87Å; F197-V263 HydrophobicContact CZ-CG1 4.06Å; D259-V263 WeakPolarHBondContact O-CB 3.43Å; D259-V263 VanDerWaalsContact O-CG2 3.29Å; D259-V263 WeakPolarHBondContact O-CG2 3.44Å; D259-V263 PolarHBondContact O-N 3.02Å; M260-V263 PolarHBondContact O-N 3.07Å; V263-Q265 VanDerWaalsContact C-N 3.34Å; V263-Q265 PolarHBondContact O-N 3.07Å; V263-L266 PolarHBondContact O-N 3.25Å; V263-L266 VanDerWaalsContact O-N 3.16Å; V263-L267 HydrophobicContact CG1-CD1 4.01Å; V263-L267 HydrophobicContact CG1-CG 4.27Å; V263-L267 VanDerWaalsContact O-CG 3.27Å; V263-L267 WeakPolarHBondContact O-CG 3.32Å; V263-L267 PolarHBondContact O-N 2.73Å
264	A	98.7	Very high	98.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.2	-46.6	177.9	0	0	0	0	0	111.8	M260 I261 L267 C268 L322 A325 V326	M260-A264 VanDerWaalsContact O-CB 3.24Å; M260-A264 WeakPolarHBondContact O-CB 3.23Å; M260-A264 PolarHBondContact O-N 3.23Å; I261-A264 PolarHBondContact O-N 2.99Å; A264-L267 PolarHBondContact O-N 3.09Å; A264-C268 PolarHBondContact O-N 2.6Å; A264-C268 PolarHBondContact O-SG 2.76Å; A264-L322 HydrophobicContact CB-CD1 3.68Å; A264-A325 HydrophobicContact CB-CB 4.42Å; A264-V326 HydrophobicContact CB-CG2 4.3Å
265	Q	98.6	Very high	98.2	Very high	56 Å²	56	34.9 Å²	34.9	26%	0.262	18%	0.183	S	C	.	.	H	α-helix	trans	-66.9	-36.6	177.2	-71.2	179.9	-17.3	0	0	112.9	I261 C262 V263 C268 K269 A325	I261-Q265 WeakPolarHBondContact O-CB 3.36Å; I261-Q265 WeakPolarHBondContact O-CG 3.04Å; I261-Q265 PolarHBondContact O-N 3.02Å; C262-Q265 PolarHBondContact O-N 2.76Å; V263-Q265 VanDerWaalsContact C-N 3.34Å; V263-Q265 PolarHBondContact O-N 3.07Å; Q265-C268 PolarHBondContact O-N 3.02Å; Q265-K269 WeakPolarHBondContact O-CG 3.4Å; Q265-K269 PolarHBondContact O-N 2.96Å; Q265-A325 WeakPolarHBondContact CG-O 3.29Å
266	L	98.6	Very high	98.2	Very high	47 Å²	47	34.3 Å²	34.3	25%	0.246	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-43.9	174.1	178.1	58.1	0	0	0	111.3	L181 R182 C262 V263 C268 K269 R270	L181-L266 HydrophobicContact CB-CD2 4.4Å; L181-L266 HydrophobicContact CD2-CD2 3.89Å; L181-L266 HydrophobicContact CD2-CG 4.24Å; L181-L266 HydrophobicContact CG-CD2 3.99Å; R182-L266 HydrophobicContact CG-CD2 3.73Å; C262-L266 WeakPolarHBondContact O-CB 3.3Å; C262-L266 PolarHBondContact O-N 3.2Å; V263-L266 PolarHBondContact O-N 3.25Å; V263-L266 VanDerWaalsContact O-N 3.16Å; L266-C268 VanDerWaalsContact C-N 3.34Å; L266-C268 PolarHBondContact O-N 2.84Å; L266-K269 PolarHBondContact O-N 3.41Å; L266-R270 HydrophobicContact CD1-CG 4.28Å; L266-R270 WeakPolarHBondContact O-CG 3.48Å; L266-R270 PolarHBondContact O-N 2.74Å
267	L	98.8	Very high	98.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-45.9	174.4	-68.3	173.1	0	0	0	111.1	L181 F191 V263 A264 K269 R270 I271 A278 L280	L181-L267 HydrophobicContact CD2-CD2 3.73Å; L181-L267 HydrophobicContact CD2-CG 4.16Å; F191-L267 HydrophobicContact CB-CD2 3.6Å; F191-L267 HydrophobicContact CD1-CD2 3.47Å; F191-L267 VanDerWaalsContact CD1-CD2 3.47Å; F191-L267 HydrophobicContact CD2-CD2 3.7Å; F191-L267 HydrophobicContact CE1-CD2 4.05Å; F191-L267 HydrophobicContact CE2-CD2 4.23Å; F191-L267 HydrophobicContact CG-CD2 3.28Å; F191-L267 HydrophobicContact CZ-CD2 4.4Å; V263-L267 HydrophobicContact CG1-CD1 4.01Å; V263-L267 HydrophobicContact CG1-CG 4.27Å; V263-L267 VanDerWaalsContact O-CG 3.27Å; V263-L267 WeakPolarHBondContact O-CG 3.32Å; V263-L267 PolarHBondContact O-N 2.73Å; A264-L267 PolarHBondContact O-N 3.09Å; L267-K269 PolarHBondContact O-N 2.88Å; L267-R270 PolarHBondContact O-N 2.86Å; L267-I271 WeakPolarHBondContact O-CB 3.39Å; L267-I271 VanDerWaalsContact O-CG1 3.31Å; L267-I271 WeakPolarHBondContact O-CG1 3.34Å; L267-I271 PolarHBondContact O-N 2.94Å; L267-A278 HydrophobicContact CD1-CB 4.25Å; L267-L280 HydrophobicContact CD1-CD1 4.31Å; L267-L280 HydrophobicContact CD1-CD2 3.92Å
268	C	98.8	Very high	98.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.9	-47.2	176.4	-64	0	0	0	0	111.9	A264 Q265 L266 R270 I271 N272 S329 A331 V333	A264-C268 PolarHBondContact O-N 2.6Å; A264-C268 PolarHBondContact O-SG 2.76Å; Q265-C268 PolarHBondContact O-N 3.02Å; L266-C268 VanDerWaalsContact C-N 3.34Å; L266-C268 PolarHBondContact O-N 2.84Å; C268-R270 VanDerWaalsContact C-N 3.34Å; C268-R270 PolarHBondContact O-N 2.72Å; C268-I271 PolarHBondContact O-N 2.7Å; C268-N272 VanDerWaalsContact O-CB 3.26Å; C268-N272 WeakPolarHBondContact O-CB 3.43Å; C268-N272 PolarHBondContact O-N 2.98Å; C268-S329 WeakPolarHBondContact CB-OG 3.5Å; C268-A331 HydrophobicContact CB-CB 3.83Å; C268-V333 HydrophobicContact CB-CG1 4.49Å; C268-V333 HydrophobicContact CB-CG2 4.12Å
269	K	98.4	Very high	98.3	Very high	120 Å²	120	33.3 Å²	33.3	52%	0.522	17%	0.174	S	C	.	.	H	α-helix	trans	-61.4	-41.5	177.4	-73.7	173.9	-178.8	175.7	0	112.1	Q265 L266 L267 K273	Q265-K269 WeakPolarHBondContact O-CG 3.4Å; Q265-K269 PolarHBondContact O-N 2.96Å; L266-K269 PolarHBondContact O-N 3.41Å; L267-K269 PolarHBondContact O-N 2.88Å; K269-K273 VanDerWaalsContact O-CB 3.28Å; K269-K273 WeakPolarHBondContact O-CB 3.28Å; K269-K273 PolarHBondContact O-N 3.26Å
270	R	98.3	Very high	98.3	Very high	9 Å²	9	29.6 Å²	29.6	3%	0.034	15%	0.154	C	C	.	.	H	α-helix	trans	-65.1	-49.6	177.3	-71.7	-175.3	66.8	124.6	1.7	111.5	L181 V184 P185 F191 L266 L267 C268 N272 K273 T274	L181-R270 PolarHBondContact O-NH1 2.93Å; V184-R270 PolarHBondContact O-NH1 2.86Å; P185-R270 PolarHBondContact O-NH2 2.93Å; F191-R270 HydrophobicContact CE2-CB 4.29Å; F191-R270 HydrophobicContact CZ-CB 4.11Å; F191-R270 VanDerWaalsContact CZ-NE 3.27Å; L266-R270 HydrophobicContact CD1-CG 4.28Å; L266-R270 WeakPolarHBondContact O-CG 3.48Å; L266-R270 PolarHBondContact O-N 2.74Å; L267-R270 PolarHBondContact O-N 2.86Å; C268-R270 VanDerWaalsContact C-N 3.34Å; C268-R270 PolarHBondContact O-N 2.72Å; R270-N272 PolarHBondContact O-N 2.73Å; R270-K273 PolarHBondContact O-N 2.94Å; R270-K273 VanDerWaalsContact O-N 3.11Å; R270-T274 PolarHBondContact O-N 3.08Å; R270-T274 PolarHBondContact O-OG1 3.12Å
271	I	98.5	Very high	98.3	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-60.4	-45.1	179.2	-68.2	165.1	0	0	0	111.1	F191 L267 C268 K273 G275 A278 V333 I392 P394	F191-I271 HydrophobicContact CD2-CG1 4.35Å; F191-I271 HydrophobicContact CE2-CG1 4.19Å; L267-I271 WeakPolarHBondContact O-CB 3.39Å; L267-I271 VanDerWaalsContact O-CG1 3.31Å; L267-I271 WeakPolarHBondContact O-CG1 3.34Å; L267-I271 PolarHBondContact O-N 2.94Å; C268-I271 PolarHBondContact O-N 2.7Å; I271-K273 VanDerWaalsContact C-N 3.28Å; I271-K273 PolarHBondContact O-N 3.34Å; I271-G275 WeakPolarHBondContact O-CA 3.48Å; I271-G275 PolarHBondContact O-N 2.96Å; I271-A278 HydrophobicContact CD1-CB 3.88Å; I271-V333 HydrophobicContact CB-CG1 4.14Å; I271-V333 HydrophobicContact CG2-CG1 3.91Å; I271-I392 HydrophobicContact CD1-CB 4Å; I271-I392 HydrophobicContact CD1-CG2 3.84Å; I271-P394 HydrophobicContact CG2-CB 4.08Å; I271-P394 HydrophobicContact CG2-CG 4.49Å
272	N	97.6	Very high	98.3	Very high	72 Å²	72	28.9 Å²	28.9	39%	0.385	15%	0.15	S	C	.	.	H	α-helix	trans	-62	-34.5	176.2	178.5	40.8	0	0	0	112.9	C268 R270 A331 K332 V333	C268-N272 VanDerWaalsContact O-CB 3.26Å; C268-N272 WeakPolarHBondContact O-CB 3.43Å; C268-N272 PolarHBondContact O-N 2.98Å; R270-N272 PolarHBondContact O-N 2.73Å; N272-A331 HydrophobicContact CB-CB 3.8Å; N272-K332 WeakPolarHBondContact OD1-CB 3.45Å; N272-K332 PolarHBondContact OD1-N 2.97Å; N272-V333 HydrophobicContact CB-CG1 4.18Å
273	K	97.4	Very high	98.2	Very high	144 Å²	144	25.5 Å²	25.5	63%	0.626	13%	0.127	S	C	*	.	H	α-helix	trans	-80.7	-43.5	-177.7	-174.8	179.7	179.8	-179.3	0	113.2	E186 K269 R270 I271	E186-K273 WeakPolarHBondContact OE2-CE 3.34Å; E186-K273 IonicContact OE2-NZ 3.85Å; E186-K273 PolarHBondContact OE2-NZ 3.27Å; K269-K273 VanDerWaalsContact O-CB 3.28Å; K269-K273 WeakPolarHBondContact O-CB 3.28Å; K269-K273 PolarHBondContact O-N 3.26Å; R270-K273 PolarHBondContact O-N 2.94Å; R270-K273 VanDerWaalsContact O-N 3.11Å; I271-K273 VanDerWaalsContact C-N 3.28Å; I271-K273 PolarHBondContact O-N 3.34Å
274	T	97.4	Very high	98.1	Very high	37 Å²	37	24.5 Å²	24.5	23%	0.227	12%	0.122	C	C	.	.	H	α-helix	trans	-121.3	1.6	-167.1	58.6	0	0	0	0	114.1	E186 N187 F188 R270	E186-T274 HydrophobicContact CB-CG2 4.48Å; N187-T274 PolarHBondContact O-OG1 2.93Å; F188-T274 WeakPolarHBondContact CA-O 3.42Å; R270-T274 PolarHBondContact O-N 3.08Å; R270-T274 PolarHBondContact O-OG1 3.12Å
275	G	97.4	Very high	98	Very high	17 Å²	17	24.6 Å²	24.6	18%	0.175	12%	0.122	C	C	.	.			trans	70.2	-171.3	-166.2	0	0	0	0	0	111.8	I271	I271-G275 WeakPolarHBondContact O-CA 3.48Å; I271-G275 PolarHBondContact O-N 2.96Å
276	G	98.1	Very high	97.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	107.2	-167.5	-174.7	0	0	0	0	0	111.7	Q106 S189 P394	Q106-G276 PolarHBondContact NE2-O 2.89Å; Q106-G276 PolarHBondContact OE1-O 3.42Å; S189-G276 CarbonylContact O-C 3.49Å; S189-G276 WeakPolarHBondContact O-CA 3.44Å; G276-P394 WeakPolarHBondContact O-CD 3.29Å
277	S	98.6	Very high	97.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	154	179.5	-65.2	0	0	0	0	108.8	E102 Q106 S189 F190 F191 I392	E102-S277 PolarHBondContact OE2-OG 2.92Å; Q106-S277 PolarHBondContact NE2-OG 2.88Å; S189-S277 PolarHBondContact O-N 3.22Å; S189-S277 VanDerWaalsContact O-N 3.16Å; F190-S277 CarbonylContact C-O 3.58Å; F190-S277 VanDerWaalsContact CA-O 3.29Å; F190-S277 WeakPolarHBondContact CA-O 3.44Å; F191-S277 PolarHBondContact N-O 3.43Å; S277-I392 CarbonylContact C-O 3.51Å; S277-I392 VanDerWaalsContact CA-O 3.26Å; S277-I392 WeakPolarHBondContact CA-O 3.21Å
278	A	98.8	Very high	97.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.4	169.5	0	0	0	0	0	110.2	F191 L267 I271 A391 I392	F191-A278 HydrophobicContact CB-CB 3.99Å; F191-A278 CarbonylContact O-C 3.56Å; F191-A278 VanDerWaalsContact O-CA 3.23Å; F191-A278 WeakPolarHBondContact O-CA 3.27Å; L267-A278 HydrophobicContact CD1-CB 4.25Å; I271-A278 HydrophobicContact CD1-CB 3.88Å; A278-A391 CarbonylContact O-C 3.5Å; A278-A391 VanDerWaalsContact O-CA 3.23Å; A278-A391 WeakPolarHBondContact O-CA 3.5Å; A278-I392 HydrophobicContact CB-CB 4.18Å; A278-I392 HydrophobicContact CB-CD1 4.39Å; A278-I392 PolarHBondContact N-O 2.9Å; A278-I392 PolarHBondContact O-N 3.36Å
279	L	98.8	Very high	97.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.3	168.5	-169.5	64.9	0	0	0	108.7	I95 W98 F191 I192 G193 I281 F344 F389 A391 F410	I95-L279 HydrophobicContact CD1-CD2 3.68Å; I95-L279 HydrophobicContact CG2-CD2 4.15Å; W98-L279 HydrophobicContact CD2-CD2 4.27Å; W98-L279 HydrophobicContact CE3-CB 4.4Å; W98-L279 HydrophobicContact CE3-CD2 4.01Å; W98-L279 HydrophobicContact CH2-CB 4.08Å; W98-L279 HydrophobicContact CH2-CD1 4.36Å; W98-L279 HydrophobicContact CZ2-CD1 4.3Å; W98-L279 HydrophobicContact CZ3-CB 3.86Å; W98-L279 HydrophobicContact CZ3-CD2 4.3Å; W98-L279 HydrophobicContact CZ3-CG 4.5Å; F191-L279 PolarHBondContact O-N 3.11Å; I192-L279 WeakPolarHBondContact CA-O 3.31Å; G193-L279 PolarHBondContact N-O 3.43Å; L279-I281 HydrophobicContact CD2-CD1 4.07Å; L279-I281 HydrophobicContact CG-CD1 4.1Å; L279-I281 HydrophobicContact CG-CG1 4.17Å; L279-F344 HydrophobicContact CD1-CE2 4.4Å; L279-F344 HydrophobicContact CD2-CZ 4.22Å; L279-F389 HydrophobicContact CD1-CD1 4.15Å; L279-F389 HydrophobicContact CD2-CD1 4.49Å; L279-F389 HydrophobicContact CD2-CE1 4.47Å; L279-F389 HydrophobicContact CG-CD1 4.47Å; L279-A391 HydrophobicContact CD1-CB 4.03Å; L279-F410 HydrophobicContact CD1-CE2 3.98Å; L279-F410 HydrophobicContact CD1-CZ 3.85Å
280	L	98.8	Very high	96.6	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	121	-174	-55.9	175.9	0	0	0	108.2	G193 F197 L267 L322 V390 I392	G193-L280 CarbonylContact O-C 3.5Å; G193-L280 WeakPolarHBondContact O-CA 3.5Å; F197-L280 HydrophobicContact CE2-CB 4.15Å; F197-L280 HydrophobicContact CE2-CD1 3.94Å; F197-L280 HydrophobicContact CE2-CD2 3.84Å; F197-L280 HydrophobicContact CE2-CG 4.17Å; F197-L280 HydrophobicContact CZ-CD1 4.25Å; F197-L280 HydrophobicContact CZ-CD2 4.09Å; L267-L280 HydrophobicContact CD1-CD1 4.31Å; L267-L280 HydrophobicContact CD1-CD2 3.92Å; L280-L322 HydrophobicContact CD1-CD1 4.24Å; L280-L322 HydrophobicContact CD1-CD2 4.24Å; L280-V390 PolarHBondContact N-O 2.85Å; L280-V390 PolarHBondContact O-N 3.27Å; L280-I392 HydrophobicContact CD1-CD1 4.07Å
281	I	98.6	Very high	96.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	120.9	-170.2	-53.9	163.4	0	0	0	107.6	F91 I95 G193 H194 E195 L279 F387 K388 F389	F91-I281 HydrophobicContact CZ-CD1 4.03Å; F91-I281 HydrophobicContact CZ-CG2 4.48Å; I95-I281 HydrophobicContact CD1-CD1 3.95Å; G193-I281 PolarHBondContact O-N 2.96Å; H194-I281 CarbonylContact C-O 3.59Å; H194-I281 VanDerWaalsContact CA-O 3.31Å; H194-I281 WeakPolarHBondContact CA-O 3.17Å; E195-I281 PolarHBondContact N-O 3.27Å; L279-I281 HydrophobicContact CD2-CD1 4.07Å; L279-I281 HydrophobicContact CG-CD1 4.1Å; L279-I281 HydrophobicContact CG-CG1 4.17Å; I281-F387 HydrophobicContact CG2-CD1 4.36Å; I281-K388 WeakPolarHBondContact CA-O 3.32Å; I281-F389 HydrophobicContact CB-CE2 4.33Å; I281-F389 HydrophobicContact CB-CZ 4.37Å; I281-F389 HydrophobicContact CD1-CD1 3.91Å; I281-F389 HydrophobicContact CD1-CE1 3.3Å; I281-F389 HydrophobicContact CD1-CE2 4.33Å; I281-F389 HydrophobicContact CD1-CZ 3.55Å; I281-F389 HydrophobicContact CG1-CD1 3.67Å; I281-F389 HydrophobicContact CG1-CD2 4.21Å; I281-F389 HydrophobicContact CG1-CE1 3.55Å; I281-F389 HydrophobicContact CG1-CE2 4.08Å; I281-F389 HydrophobicContact CG1-CG 3.99Å; I281-F389 HydrophobicContact CG1-CZ 3.77Å; I281-F389 HydrophobicContact CG2-CD2 3.84Å; I281-F389 HydrophobicContact CG2-CE1 4.36Å; I281-F389 HydrophobicContact CG2-CE2 3.37Å; I281-F389 HydrophobicContact CG2-CG 4.48Å; I281-F389 HydrophobicContact CG2-CZ 3.68Å
282	D	98	Very high	96.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	162.4	177.9	-137.9	-45.4	0	0	0	110.5	E195 F196 F197 D198 V317 F319 F387 K388	E195-D282 WeakPolarHBondContact CA-OD2 3.3Å; F196-D282 PolarHBondContact N-OD2 3.21Å; F197-D282 PolarHBondContact N-OD2 3.36Å; D198-D282 WeakPolarHBondContact CB-OD1 3.49Å; D198-D282 PolarHBondContact N-OD2 3.3Å; D282-V317 HydrophobicContact CB-CB 4.2Å; D282-V317 HydrophobicContact CB-CG2 3.64Å; D282-F319 HydrophobicContact CB-CE2 4.39Å; D282-F319 HydrophobicContact CB-CZ 4.06Å; D282-F387 WeakPolarHBondContact O-CA 3.19Å; D282-K388 PolarHBondContact N-O 3.47Å; D282-K388 PolarHBondContact O-N 2.87Å
283	Y	95.7	Very high	96.1	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.012	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.6	169.2	56.1	-84.9	0	0	0	110.7	E195 D198 T314 D316 V317 R386 F387	E195-Y283 HydrophobicContact CG-CD1 4.46Å; D198-Y283 HydrophobicContact CB-CE1 4.04Å; D198-Y283 HydrophobicContact CB-CE2 4.23Å; D198-Y283 WeakPolarHBondContact OD2-CE1 3.11Å; D198-Y283 PolarHBondContact OD2-OH 3.18Å; Y283-T314 VanDerWaalsContact OH-CB 3.29Å; Y283-T314 WeakPolarHBondContact OH-CB 3.45Å; Y283-T314 VanDerWaalsContact OH-CG2 3.25Å; Y283-T314 WeakPolarHBondContact OH-CG2 3.35Å; Y283-T314 PolarHBondContact OH-OG1 2.69Å; Y283-D316 HydrophobicContact CD2-CB 4.5Å; Y283-D316 VanDerWaalsContact CD2-OD1 3.28Å; Y283-D316 WeakPolarHBondContact CD2-OD1 3.26Å; Y283-D316 WeakPolarHBondContact CE2-OD1 3.38Å; Y283-V317 PolarHBondContact O-N 3.07Å; Y283-R386 WeakPolarHBondContact CA-O 3.33Å; Y283-F387 AromaticContact CD1-CE1 3.9Å; Y283-F387 HydrophobicContact CD1-CE1 3.9Å; Y283-F387 HydrophobicContact CD1-CE2 4.34Å; Y283-F387 AromaticContact CD1-CZ 3.68Å; Y283-F387 HydrophobicContact CD1-CZ 3.68Å; Y283-F387 HydrophobicContact CG-CZ 4.32Å
284	G	96.8	Very high	96	Very high	4 Å²	4	27.3 Å²	27.3	4%	0.041	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	-171.7	-165.4	0	0	0	0	0	115.2	V317 R386	G284-V317 CarbonylContact C-O 3.51Å; G284-V317 WeakPolarHBondContact CA-O 3.39Å; G284-R386 PolarHBondContact N-O 2.86Å; G284-R386 VanDerWaalsContact N-O 3.09Å
285	H	96.6	Very high	95.8	Very high	3 Å²	3	25.5 Å²	25.5	1%	0.014	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	170.6	-179.5	62.1	94.7	0	0	0	110.1	G287 E288 K289 V317 D318 F319	H285-G287 PolarHBondContact ND1-N 3.42Å; H285-E288 VanDerWaalsContact CB-OE1 3.29Å; H285-E288 WeakPolarHBondContact CB-OE1 3.37Å; H285-K289 HydrophobicContact CB-CB 4.24Å; H285-K289 HydrophobicContact CB-CD 3.98Å; H285-K289 HydrophobicContact CB-CG 3.83Å; H285-K289 PolarHBondContact CE1-O 3.24Å; H285-V317 PolarHBondContact N-O 3.17Å; H285-D318 IonicContact CE1-OD2 3.9Å; H285-F319 PolarHBondContact O-N 3.42Å
286	E	96.2	Very high	95.4	Very high	100 Å²	100	25.6 Å²	25.6	47%	0.467	13%	0.129	S	C	.	.	S	Bend	trans	-110.6	27.2	-178.4	-63.7	-179.5	-112.2	0	0	111.7	E288 F319 S320 P338	E286-E288 VanDerWaalsContact C-OE2 3.32Å; E286-E288 WeakPolarHBondContact CA-OE2 3.36Å; E286-E288 PolarHBondContact N-OE2 3.47Å; E286-F319 HydrophobicContact CG-CB 4.34Å; E286-S320 WeakPolarHBondContact O-CB 3.44Å; E286-P338 VanDerWaalsContact CD-CG 3.42Å; E286-P338 HydrophobicContact CG-CG 3.83Å; E286-P338 WeakPolarHBondContact OE2-CG 3.39Å
287	G	94.8	Very high	94.7	Very high	14 Å²	14	27.8 Å²	27.8	14%	0.144	14%	0.139	C	C	.	.	S	Bend	trans	105.3	1.4	175.9	0	0	0	0	0	116.8	R251 H285	R251-G287 PolarHBondContact NH1-O 2.86Å; H285-G287 PolarHBondContact ND1-N 3.42Å
288	E	94.3	Very high	93.9	Very high	129 Å²	129	34.6 Å²	34.6	60%	0.603	17%	0.169	S	C	*	.	S	Bend	trans	-80.3	-19.1	178.8	73.5	-79	-173.9	0	0	114.1	H285 E286	H285-E288 VanDerWaalsContact CB-OE1 3.29Å; H285-E288 WeakPolarHBondContact CB-OE1 3.37Å; E286-E288 VanDerWaalsContact C-OE2 3.32Å; E286-E288 WeakPolarHBondContact CA-OE2 3.36Å; E286-E288 PolarHBondContact N-OE2 3.47Å
289	K	93.5	Very high	92.8	Very high	83 Å²	83	40 Å²	40	36%	0.361	19%	0.194	S	C	.	.			trans	-99.5	157.3	172.2	-51.9	-175.1	-171.3	177.1	0	110.7	H285 T292 D316	H285-K289 HydrophobicContact CB-CB 4.24Å; H285-K289 HydrophobicContact CB-CD 3.98Å; H285-K289 HydrophobicContact CB-CG 3.83Å; H285-K289 PolarHBondContact CE1-O 3.24Å; K289-T292 HydrophobicContact CB-CG2 3.83Å; K289-T292 HydrophobicContact CD-CG2 3.92Å; K289-D316 IonicContact NZ-OD2 3.66Å; K289-D316 PolarHBondContact NZ-OD2 3.46Å
290	G	83.8	Confident	92.2	Very high	15 Å²	15	43.5 Å²	43.5	16%	0.155	22%	0.218	C	C	.	.			trans	-141.9	-11.7	179.4	0	0	0	0	0	116.5	S253	S253-G290 WeakPolarHBondContact CB-O 3.32Å; S253-G290 WeakPolarHBondContact OG-CA 3.32Å; S253-G290 PolarHBondContact OG-O 3.45Å
291	D	90.3	Very high	91.8	Very high	103 Å²	103	48 Å²	48	55%	0.551	25%	0.246	S	C	*	.			trans	-135.7	103.7	171.2	-171.8	5	0	0	0	108.6	R204	R204-D291 IonicContact CZ-OD1 2.62Å; R204-D291 IonicContact NE-OD1 3.4Å; R204-D291 IonicContact NH2-OD1 3.74Å; R204-D291 PolarHBondContact NH2-OD1 2.93Å; R204-D291 IonicContact NH2-OD2 3.45Å; R204-D291 PolarHBondContact NH2-OD2 3.27Å; R204-D291 VanDerWaalsContact NH2-OD2 3.13Å
292	T	96.2	Very high	91.4	Very high	9 Å²	9	49.9 Å²	49.9	6%	0.055	26%	0.258	C	S	.	.			trans	-128.3	-9.9	-176	75	0	0	0	0	112.5	E255 K289 R294 C315 D316	E255-T292 PolarHBondContact OE1-N 3Å; E255-T292 WeakPolarHBondContact OE2-CB 3.46Å; E255-T292 PolarHBondContact OE2-N 2.8Å; E255-T292 VanDerWaalsContact OE2-N 3.15Å; E255-T292 PolarHBondContact OE2-OG1 3.4Å; K289-T292 HydrophobicContact CB-CG2 3.83Å; K289-T292 HydrophobicContact CD-CG2 3.92Å; T292-R294 WeakPolarHBondContact O-CG 3.28Å; T292-R294 PolarHBondContact O-N 3.15Å; T292-R294 PolarHBondContact O-NH1 2.68Å; T292-C315 PolarHBondContact OG1-SG 3.16Å; T292-C315 VanDerWaalsContact OG1-SG 3.4Å; T292-D316 HydrophobicContact CG2-CB 3.85Å; T292-D316 WeakPolarHBondContact OG1-CB 3.24Å; T292-D316 PolarHBondContact OG1-N 2.92Å
293	F	97	Very high	91.3	Very high	13 Å²	13	53.7 Å²	53.7	6%	0.057	28%	0.279	C	S	.	.			trans	-59.7	120.7	177.1	-178.9	-118.6	0	0	0	112.7	V53 Y56 M57 F228 E255 P304 L313 T314	V53-F293 HydrophobicContact CG1-CD1 4.16Å; V53-F293 HydrophobicContact CG1-CE1 3.97Å; V53-F293 HydrophobicContact CG1-CE2 4.38Å; V53-F293 HydrophobicContact CG1-CG 4.42Å; V53-F293 HydrophobicContact CG1-CZ 4.09Å; Y56-F293 HydrophobicContact CD1-CZ 4.34Å; Y56-F293 HydrophobicContact CE1-CZ 4.46Å; M57-F293 HydrophobicContact CE-CD2 4.47Å; M57-F293 HydrophobicContact CE-CE2 4.13Å; M57-F293 HydrophobicContact CG-CD2 4.43Å; M57-F293 HydrophobicContact CG-CE2 3.48Å; M57-F293 VanDerWaalsContact CG-CE2 3.48Å; M57-F293 HydrophobicContact CG-CZ 3.82Å; M57-F293 HydrophobicContact SD-CD2 3.97Å; M57-F293 HydrophobicContact SD-CE2 3.58Å; M57-F293 VanDerWaalsContact SD-CE2 3.58Å; M57-F293 HydrophobicContact SD-CZ 4.39Å; F228-F293 HydrophobicContact CE1-CD1 4.39Å; F228-F293 HydrophobicContact CE1-CE1 4.21Å; F228-F293 AromaticContact CZ-CD1 3.93Å; F228-F293 HydrophobicContact CZ-CD1 3.93Å; F228-F293 AromaticContact CZ-CE1 3.85Å; F228-F293 HydrophobicContact CZ-CE1 3.85Å; E255-F293 PolarHBondContact OE1-N 2.77Å; F293-P304 HydrophobicContact CD1-CB 4.19Å; F293-P304 HydrophobicContact CD1-CG 3.82Å; F293-P304 HydrophobicContact CE1-CB 3.51Å; F293-P304 HydrophobicContact CE1-CG 3.51Å; F293-P304 HydrophobicContact CE2-CB 4.49Å; F293-P304 HydrophobicContact CZ-CB 3.69Å; F293-P304 HydrophobicContact CZ-CG 4.22Å; F293-L313 HydrophobicContact CE2-CB 4.05Å; F293-L313 HydrophobicContact CE2-CD1 4.44Å; F293-L313 HydrophobicContact CZ-CB 4.47Å; F293-L313 HydrophobicContact CZ-CD1 4.11Å; F293-L313 HydrophobicContact CZ-CD2 4.4Å; F293-T314 WeakPolarHBondContact CA-O 3.47Å
294	R	95.8	Very high	91.3	Very high	39 Å²	39	54.1 Å²	54.1	15%	0.147	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165.3	-175.9	63.7	-162.2	177.9	-94.7	-3.4	111.5	T292 F296 V301 T314 D316 R386	T292-R294 WeakPolarHBondContact O-CG 3.28Å; T292-R294 PolarHBondContact O-N 3.15Å; T292-R294 PolarHBondContact O-NH1 2.68Å; R294-F296 HydrophobicContact CG-CD2 4.26Å; R294-F296 HydrophobicContact CG-CE2 3.75Å; R294-F296 HydrophobicContact CG-CZ 4.49Å; R294-V301 HydrophobicContact CB-CG1 4.21Å; R294-T314 HydrophobicContact CG-CG2 4.05Å; R294-T314 PolarHBondContact N-O 2.59Å; R294-T314 PolarHBondContact O-N 2.77Å; R294-D316 IonicContact CZ-OD1 4Å; R294-D316 IonicContact NH1-OD1 2.66Å; R294-D316 PolarHBondContact NH1-OD1 3.16Å; R294-D316 IonicContact NH2-OD1 3.74Å; R294-D316 PolarHBondContact NH2-OD1 3.46Å; R294-R386 VanDerWaalsContact NH2-NH2 3.1Å
295	G	93.2	Very high	91.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	151.6	170.2	0	0	0	0	0	112	V301 C302 D312	G295-V301 WeakPolarHBondContact O-CA 3.26Å; G295-C302 VanDerWaalsContact C-SG 3.53Å; G295-C302 PolarHBondContact N-O 3.04Å; G295-C302 VanDerWaalsContact N-O 3.12Å; G295-C302 PolarHBondContact O-N 3.29Å; G295-D312 CarbonylContact C-O 3.53Å; G295-D312 WeakPolarHBondContact CA-O 3.19Å
296	F	88.7	Confident	91.2	Very high	18 Å²	18	58.3 Å²	58.3	8%	0.079	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.9	165.6	-73.6	-97.2	0	0	0	110.8	F81 R294 S300 V301 T311 D312 T314	F81-F296 HydrophobicContact CE1-CB 4.11Å; F81-F296 AromaticContact CE1-CD1 3.71Å; F81-F296 HydrophobicContact CE1-CD1 3.71Å; F81-F296 AromaticContact CE1-CD2 3.99Å; F81-F296 HydrophobicContact CE1-CD2 3.99Å; F81-F296 AromaticContact CE1-CE1 4Å; F81-F296 HydrophobicContact CE1-CE1 4Å; F81-F296 HydrophobicContact CE1-CE2 4.21Å; F81-F296 AromaticContact CE1-CG 3.69Å; F81-F296 HydrophobicContact CE1-CG 3.69Å; F81-F296 HydrophobicContact CE1-CZ 4.22Å; F81-F296 HydrophobicContact CE2-CB 3.61Å; F81-F296 HydrophobicContact CE2-CD2 4.27Å; F81-F296 HydrophobicContact CE2-CG 4.01Å; F81-F296 HydrophobicContact CZ-CB 3.28Å; F81-F296 AromaticContact CZ-CD1 3.69Å; F81-F296 HydrophobicContact CZ-CD1 3.69Å; F81-F296 AromaticContact CZ-CD2 3.31Å; F81-F296 HydrophobicContact CZ-CD2 3.31Å; F81-F296 HydrophobicContact CZ-CE1 4.26Å; F81-F296 AromaticContact CZ-CE2 3.88Å; F81-F296 HydrophobicContact CZ-CE2 3.88Å; F81-F296 AromaticContact CZ-CG 3.15Å; F81-F296 HydrophobicContact CZ-CG 3.15Å; F81-F296 HydrophobicContact CZ-CZ 4.33Å; R294-F296 HydrophobicContact CG-CD2 4.26Å; R294-F296 HydrophobicContact CG-CE2 3.75Å; R294-F296 HydrophobicContact CG-CZ 4.49Å; F296-S300 WeakPolarHBondContact CA-O 3.36Å; F296-V301 HydrophobicContact CD1-CG2 4.22Å; F296-V301 HydrophobicContact CE1-CG2 3.61Å; F296-V301 HydrophobicContact CZ-CG2 3.94Å; F296-T311 WeakPolarHBondContact O-CG2 3.37Å; F296-D312 HydrophobicContact CB-CB 4.46Å; F296-D312 PolarHBondContact N-O 2.88Å; F296-D312 PolarHBondContact O-N 2.85Å; F296-T314 HydrophobicContact CD2-CG2 3.65Å; F296-T314 HydrophobicContact CE2-CG2 3.5Å
297	H	84.7	Confident	91	Very high	46 Å²	46	56.2 Å²	56.2	21%	0.213	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	124.6	172.5	-171.5	66.3	0	0	0	108.7	D80 H299 S300 H310	D80-H297 IonicContact OD2-ND1 2.59Å; H297-H299 PolarHBondContact O-N 3.28Å; H297-S300 PolarHBondContact N-O 2.87Å; H297-S300 PolarHBondContact O-N 2.97Å; H297-H310 AromaticContact CE1-CE1 3.21Å; H297-H310 PolarHBondContact CE1-CE1 2.88Å; H297-H310 AromaticContact CE1-ND1 3.61Å; H297-H310 AromaticContact ND1-CE1 3.99Å; H297-H310 AromaticContact ND1-ND1 3.99Å; H297-H310 PolarHBondContact ND1-O 3.4Å; H297-H310 AromaticContact NE2-CE1 3.77Å
298	K	80.7	Confident	91	Very high	143 Å²	143	55.7 Å²	55.7	62%	0.622	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	51.5	-178.1	-61.6	174.9	-178.7	168.2	0	113.1	D80 S300	D80-K298 WeakPolarHBondContact OD1-CA 3.36Å; D80-K298 PolarHBondContact OD1-N 3.19Å; K298-S300 PolarHBondContact O-N 2.98Å; K298-S300 VanDerWaalsContact O-N 3.16Å
299	H	77.2	Confident	90.9	Very high	115 Å²	115	49.7 Å²	49.7	53%	0.532	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	12.2	-178.3	-47.4	106.8	0	0	0	115.8	G79 D80 H297	G79-H299 PolarHBondContact O-CE1 2.97Å; G79-H299 PolarHBondContact O-NE2 3.38Å; D80-H299 PolarHBondContact O-CD2 3.06Å; D80-H299 PolarHBondContact O-N 3.44Å; H297-H299 PolarHBondContact O-N 3.28Å
300	S	85.5	Confident	90.7	Very high	73 Å²	73	46.6 Å²	46.6	51%	0.51	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.8	175.5	-61.7	0	0	0	0	110.9	F296 H297 K298	F296-S300 WeakPolarHBondContact CA-O 3.36Å; H297-S300 PolarHBondContact N-O 2.87Å; H297-S300 PolarHBondContact O-N 2.97Å; K298-S300 PolarHBondContact O-N 2.98Å; K298-S300 VanDerWaalsContact O-N 3.16Å
301	V	90	Very high	91	Very high	97 Å²	97	45.9 Å²	45.9	59%	0.588	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.5	169.8	-178.5	0	0	0	0	108.8	R294 G295 F296	R294-V301 HydrophobicContact CB-CG1 4.21Å; G295-V301 WeakPolarHBondContact O-CA 3.26Å; F296-V301 HydrophobicContact CD1-CG2 4.22Å; F296-V301 HydrophobicContact CE1-CG2 3.61Å; F296-V301 HydrophobicContact CZ-CG2 3.94Å
302	C	91.5	Very high	91.1	Very high	40 Å²	40	41.4 Å²	41.4	27%	0.27	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	165.1	175.2	60.7	0	0	0	0	111.4	G295 T311	G295-C302 VanDerWaalsContact C-SG 3.53Å; G295-C302 PolarHBondContact N-O 3.04Å; G295-C302 VanDerWaalsContact N-O 3.12Å; G295-C302 PolarHBondContact O-N 3.29Å; C302-T311 WeakPolarHBondContact SG-CG2 2.95Å
303	D	94.6	Very high	91	Very high	81 Å²	81	41.1 Å²	41.1	43%	0.433	22%	0.215	S	C	.	.			trans	-65.8	124	174.4	176.7	-19.8	0	0	0	109.3	L305 I306	D303-L305 PolarHBondContact O-N 3.41Å; D303-L305 VanDerWaalsContact O-N 3.07Å; D303-L305 WeakPolarHBondContact OD1-CB 3.42Å; D303-L305 PolarHBondContact OD1-N 3.22Å; D303-I306 HydrophobicContact CB-CD1 3.64Å; D303-I306 HydrophobicContact CB-CG1 3.78Å; D303-I306 PolarHBondContact O-N 2.75Å
304	P	96.4	Very high	91	Very high	11 Å²	11	40.5 Å²	40.5	7%	0.071	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.5	-175.5	27.3	-36.6	0	0	0	113.9	Y56 F228 F293 L313	Y56-P304 PolarHBondContact OH-O 2.91Å; F228-P304 HydrophobicContact CE2-CG 4.34Å; F228-P304 HydrophobicContact CZ-CG 3.99Å; F293-P304 HydrophobicContact CD1-CB 4.19Å; F293-P304 HydrophobicContact CD1-CG 3.82Å; F293-P304 HydrophobicContact CE1-CB 3.51Å; F293-P304 HydrophobicContact CE1-CG 3.51Å; F293-P304 HydrophobicContact CE2-CB 4.49Å; F293-P304 HydrophobicContact CZ-CB 3.69Å; F293-P304 HydrophobicContact CZ-CG 4.22Å; P304-L313 HydrophobicContact CB-CD2 3.53Å
305	L	96.8	Very high	91.1	Very high	9 Å²	9	38.8 Å²	38.8	5%	0.047	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-9.7	-174.9	-60.9	-173.1	0	0	0	114.8	Y56 V217 L226 F228 D303	Y56-L305 HydrophobicContact CD1-CD2 4.25Å; Y56-L305 HydrophobicContact CE1-CD2 3.71Å; Y56-L305 HydrophobicContact CE2-CD2 4.22Å; V217-L305 HydrophobicContact CG1-CD2 3.9Å; V217-L305 HydrophobicContact CG2-CD2 4.09Å; L226-L305 HydrophobicContact CB-CB 4.08Å; L226-L305 HydrophobicContact CB-CD1 4.23Å; L226-L305 HydrophobicContact CB-CD2 4.46Å; L226-L305 HydrophobicContact CB-CG 4.5Å; F228-L305 HydrophobicContact CD1-CD1 4.29Å; F228-L305 HydrophobicContact CD2-CD1 3.92Å; F228-L305 HydrophobicContact CE1-CD1 4.13Å; F228-L305 HydrophobicContact CE1-CD2 4.09Å; F228-L305 HydrophobicContact CE1-CG 4.33Å; F228-L305 HydrophobicContact CE2-CD1 3.75Å; F228-L305 HydrophobicContact CE2-CG 4.02Å; F228-L305 HydrophobicContact CG-CD1 4.19Å; F228-L305 HydrophobicContact CZ-CD1 3.86Å; F228-L305 HydrophobicContact CZ-CD2 3.96Å; F228-L305 HydrophobicContact CZ-CG 3.83Å; D303-L305 PolarHBondContact O-N 3.41Å; D303-L305 VanDerWaalsContact O-N 3.07Å; D303-L305 WeakPolarHBondContact OD1-CB 3.42Å; D303-L305 PolarHBondContact OD1-N 3.22Å
306	I	93.7	Very high	91.3	Very high	86 Å²	86	39.1 Å²	39.1	44%	0.441	21%	0.208	S	C	.	.	S	Bend	trans	-72.5	-54.1	-170.6	-65.9	178.9	0	0	0	111.9	K38 D303 P308	K38-I306 PolarHBondContact NZ-O 3.16Å; D303-I306 HydrophobicContact CB-CD1 3.64Å; D303-I306 HydrophobicContact CB-CG1 3.78Å; D303-I306 PolarHBondContact O-N 2.75Å; I306-P308 WeakPolarHBondContact O-CD 3.29Å
307	N	92.7	Very high	91.7	Very high	57 Å²	57	38.6 Å²	38.6	31%	0.305	21%	0.206	S	C	.	.	S	Bend	trans	-123.7	74.5	-175.3	-58	-44.6	0	0	0	111.3	S34 G309 H310 T311	S34-N307 VanDerWaalsContact OG-C 3.27Å; S34-N307 WeakPolarHBondContact OG-CA 3.43Å; N307-G309 PolarHBondContact O-N 3.22Å; N307-H310 HydrophobicContact CB-CB 3.93Å; N307-H310 PolarHBondContact O-N 2.8Å; N307-H310 VanDerWaalsContact O-N 3.13Å; N307-T311 PolarHBondContact O-N 3.47Å; N307-T311 PolarHBondContact O-OG1 3.49Å
308	P	94.6	Very high	92.3	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.013	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	135.3	176.3	-22.4	30.8	0	0	0	111.5	S34 L37 K38 L41 Y56 L226 I306 H310	S34-P308 WeakPolarHBondContact CA-O 3.48Å; S34-P308 WeakPolarHBondContact CB-O 3.41Å; S34-P308 PolarHBondContact OG-O 3.31Å; L37-P308 HydrophobicContact CD2-CB 4.01Å; L37-P308 HydrophobicContact CG-CB 4.2Å; K38-P308 HydrophobicContact CB-CG 3.95Å; K38-P308 HydrophobicContact CG-CG 4.18Å; L41-P308 HydrophobicContact CD1-CB 3.88Å; L41-P308 HydrophobicContact CD1-CG 4.25Å; Y56-P308 HydrophobicContact CE2-CB 4.33Å; Y56-P308 HydrophobicContact CE2-CG 4.26Å; Y56-P308 WeakPolarHBondContact OH-CG 3.39Å; L226-P308 HydrophobicContact CD1-CG 3.94Å; I306-P308 WeakPolarHBondContact O-CD 3.29Å; P308-H310 PolarHBondContact O-N 3.21Å
309	G	92.3	Very high	93.2	Very high	3 Å²	3	30 Å²	30	3%	0.031	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-12.5	179.2	0	0	0	0	0	115.8	C60 Y66 Y68 H72 N307	C60-G309 WeakPolarHBondContact O-CA 3.21Å; Y66-G309 WeakPolarHBondContact O-CA 3.21Å; Y68-G309 WeakPolarHBondContact CA-O 3.43Å; Y68-G309 PolarHBondContact N-O 2.9Å; H72-G309 PolarHBondContact CE1-O 3.26Å; N307-G309 PolarHBondContact O-N 3.22Å
310	H	89.7	Confident	94.2	Very high	18 Å²	18	25.8 Å²	25.8	8%	0.083	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-5.7	-177.6	-166.1	-113.3	0	0	0	113.7	Q30 H72 H297 N307 P308	Q30-H310 PolarHBondContact OE1-NE2 2.88Å; H72-H310 AromaticContact CE1-CD2 3.71Å; H72-H310 AromaticContact NE2-CD2 2.98Å; H72-H310 PolarHBondContact NE2-CD2 2.89Å; H72-H310 AromaticContact NE2-CG 3.85Å; H72-H310 AromaticContact NE2-NE2 3.6Å; H297-H310 AromaticContact CE1-CE1 3.21Å; H297-H310 PolarHBondContact CE1-CE1 2.88Å; H297-H310 AromaticContact CE1-ND1 3.61Å; H297-H310 AromaticContact ND1-CE1 3.99Å; H297-H310 AromaticContact ND1-ND1 3.99Å; H297-H310 PolarHBondContact ND1-O 3.4Å; H297-H310 AromaticContact NE2-CE1 3.77Å; N307-H310 HydrophobicContact CB-CB 3.93Å; N307-H310 PolarHBondContact O-N 2.8Å; N307-H310 VanDerWaalsContact O-N 3.13Å; P308-H310 PolarHBondContact O-N 3.21Å
311	T	90.6	Very high	94.8	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	13%	0.128	C	C	.	.	S	Bend	trans	-118.5	136.2	-176.9	-57.4	0	0	0	0	108.6	F296 C302 N307 L313	F296-T311 WeakPolarHBondContact O-CG2 3.37Å; C302-T311 WeakPolarHBondContact SG-CG2 2.95Å; N307-T311 PolarHBondContact O-N 3.47Å; N307-T311 PolarHBondContact O-OG1 3.49Å; T311-L313 HydrophobicContact CG2-CD2 4.03Å; T311-L313 PolarHBondContact O-N 3.44Å
312	D	90.8	Very high	95.2	Very high	9 Å²	9	17.8 Å²	17.8	5%	0.048	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	104	172.8	-158.7	-8.1	0	0	0	109.1	Y68 Y69 F81 G295 F296	Y68-D312 HydrophobicContact CD1-CB 4.24Å; Y68-D312 HydrophobicContact CE1-CB 3.65Å; Y68-D312 WeakPolarHBondContact CE1-OD2 3.47Å; Y68-D312 HydrophobicContact CE2-CB 4.21Å; Y69-D312 PolarHBondContact OH-OD1 2.97Å; F81-D312 HydrophobicContact CD2-CB 4.5Å; F81-D312 WeakPolarHBondContact CD2-OD2 3.16Å; F81-D312 HydrophobicContact CE2-CB 3.78Å; F81-D312 WeakPolarHBondContact CE2-OD2 3.29Å; G295-D312 CarbonylContact C-O 3.53Å; G295-D312 WeakPolarHBondContact CA-O 3.19Å; F296-D312 HydrophobicContact CB-CB 4.46Å; F296-D312 PolarHBondContact N-O 2.88Å; F296-D312 PolarHBondContact O-N 2.85Å
313	L	95.7	Very high	95.5	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.6	-178.7	-59.2	-175.3	0	0	0	110.1	Y56 M57 C60 L61 F293 P304 T311	Y56-L313 HydrophobicContact CD1-CD1 4.09Å; Y56-L313 HydrophobicContact CE1-CD1 3.64Å; M57-L313 HydrophobicContact CG-CD1 4.4Å; C60-L313 HydrophobicContact CB-CD1 3.41Å; C60-L313 VanDerWaalsContact CB-CD1 3.41Å; C60-L313 HydrophobicContact CB-CG 4.29Å; L61-L313 HydrophobicContact CD1-CB 4.18Å; L61-L313 WeakPolarHBondContact CD1-O 3.42Å; L61-L313 HydrophobicContact CD2-CB 3.94Å; L61-L313 HydrophobicContact CD2-CG 4.39Å; L61-L313 HydrophobicContact CG-CB 4.15Å; F293-L313 HydrophobicContact CE2-CB 4.05Å; F293-L313 HydrophobicContact CE2-CD1 4.44Å; F293-L313 HydrophobicContact CZ-CB 4.47Å; F293-L313 HydrophobicContact CZ-CD1 4.11Å; F293-L313 HydrophobicContact CZ-CD2 4.4Å; P304-L313 HydrophobicContact CB-CD2 3.53Å; T311-L313 HydrophobicContact CG2-CD2 4.03Å; T311-L313 PolarHBondContact O-N 3.44Å
314	T	95.9	Very high	95.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	156.6	-178	-176	0	0	0	0	112.8	D198 Y283 F293 R294 F296	D198-T314 WeakPolarHBondContact CB-OG1 3.38Å; D198-T314 WeakPolarHBondContact O-CA 3.42Å; D198-T314 PolarHBondContact O-OG1 3.4Å; D198-T314 PolarHBondContact OD2-OG1 3.25Å; Y283-T314 VanDerWaalsContact OH-CB 3.29Å; Y283-T314 WeakPolarHBondContact OH-CB 3.45Å; Y283-T314 VanDerWaalsContact OH-CG2 3.25Å; Y283-T314 WeakPolarHBondContact OH-CG2 3.35Å; Y283-T314 PolarHBondContact OH-OG1 2.69Å; F293-T314 WeakPolarHBondContact CA-O 3.47Å; R294-T314 HydrophobicContact CG-CG2 4.05Å; R294-T314 PolarHBondContact N-O 2.59Å; R294-T314 PolarHBondContact O-N 2.77Å; F296-T314 HydrophobicContact CD2-CG2 3.65Å; F296-T314 HydrophobicContact CE2-CG2 3.5Å
315	C	97.2	Very high	95.8	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.02	8%	0.082	C	C	.	.			trans	-132.7	133.4	175.1	-172.2	0	0	0	0	109	D198 V202 E255 T292 V317	D198-C315 WeakPolarHBondContact CA-O 3.36Å; D198-C315 VanDerWaalsContact CB-O 3.29Å; D198-C315 WeakPolarHBondContact CB-O 3.46Å; D198-C315 PolarHBondContact O-N 3.15Å; V202-C315 HydrophobicContact CG1-CB 3.91Å; V202-C315 HydrophobicContact CG2-CB 4.14Å; E255-C315 VanDerWaalsContact CB-SG 3.51Å; E255-C315 VanDerWaalsContact CG-SG 3.54Å; E255-C315 PolarHBondContact OE2-SG 3.19Å; T292-C315 PolarHBondContact OG1-SG 3.16Å; T292-C315 VanDerWaalsContact OG1-SG 3.4Å; C315-V317 PolarHBondContact O-N 3.13Å
316	D	97.5	Very high	95.9	Very high	7 Å²	7	14.9 Å²	14.9	4%	0.037	8%	0.081	C	C	.	.			trans	-60.2	140.3	173.2	-72.9	12.9	0	0	0	109.5	Y283 K289 T292 R294 D318	Y283-D316 HydrophobicContact CD2-CB 4.5Å; Y283-D316 VanDerWaalsContact CD2-OD1 3.28Å; Y283-D316 WeakPolarHBondContact CD2-OD1 3.26Å; Y283-D316 WeakPolarHBondContact CE2-OD1 3.38Å; K289-D316 IonicContact NZ-OD2 3.66Å; K289-D316 PolarHBondContact NZ-OD2 3.46Å; T292-D316 HydrophobicContact CG2-CB 3.85Å; T292-D316 WeakPolarHBondContact OG1-CB 3.24Å; T292-D316 PolarHBondContact OG1-N 2.92Å; R294-D316 IonicContact CZ-OD1 4Å; R294-D316 IonicContact NH1-OD1 2.66Å; R294-D316 PolarHBondContact NH1-OD1 3.16Å; R294-D316 IonicContact NH2-OD1 3.74Å; R294-D316 PolarHBondContact NH2-OD1 3.46Å; D316-D318 PolarHBondContact O-N 3.09Å
317	V	98.3	Very high	96	Very high	7 Å²	7	18.3 Å²	18.3	4%	0.042	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.6	179.1	175.2	0	0	0	0	110.7	F197 D198 M260 D282 Y283 G284 H285 C315 F319	F197-V317 HydrophobicContact CB-CG2 3.68Å; D198-V317 HydrophobicContact CB-CG2 4.35Å; M260-V317 HydrophobicContact SD-CG1 3.7Å; D282-V317 HydrophobicContact CB-CB 4.2Å; D282-V317 HydrophobicContact CB-CG2 3.64Å; Y283-V317 PolarHBondContact O-N 3.07Å; G284-V317 CarbonylContact C-O 3.51Å; G284-V317 WeakPolarHBondContact CA-O 3.39Å; H285-V317 PolarHBondContact N-O 3.17Å; C315-V317 PolarHBondContact O-N 3.13Å; V317-F319 HydrophobicContact CB-CD2 4.18Å; V317-F319 HydrophobicContact CB-CE2 3.8Å; V317-F319 HydrophobicContact CB-CZ 4.44Å; V317-F319 HydrophobicContact CG1-CD2 3.89Å; V317-F319 HydrophobicContact CG1-CE2 3.74Å; V317-F319 HydrophobicContact CG1-CG 4.38Å; V317-F319 HydrophobicContact CG1-CZ 4.12Å; V317-F319 WeakPolarHBondContact O-CD2 3.28Å; V317-F319 PolarHBondContact O-N 3.07Å
318	D	97.9	Very high	96.2	Very high	6 Å²	6	19.5 Å²	19.5	3%	0.032	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	95.4	167.7	-169.4	-28.1	0	0	0	110.2	R251 H285 D316 S320 I321 L322	R251-D318 IonicContact CZ-OD2 2.68Å; R251-D318 IonicContact NH1-OD2 3.13Å; R251-D318 PolarHBondContact NH1-OD2 3.35Å; R251-D318 IonicContact NH2-OD1 3.56Å; R251-D318 IonicContact NH2-OD2 3.71Å; R251-D318 PolarHBondContact NH2-OD2 3.4Å; H285-D318 IonicContact CE1-OD2 3.9Å; D316-D318 PolarHBondContact O-N 3.09Å; D318-S320 PolarHBondContact O-N 3.35Å; D318-S320 WeakPolarHBondContact OD1-CA 3.43Å; D318-S320 VanDerWaalsContact OD1-CB 3.25Å; D318-S320 WeakPolarHBondContact OD1-CB 3.39Å; D318-S320 PolarHBondContact OD1-N 2.86Å; D318-S320 PolarHBondContact OD1-OG 3.16Å; D318-I321 HydrophobicContact CB-CB 4.37Å; D318-I321 HydrophobicContact CB-CD1 3.93Å; D318-I321 HydrophobicContact CB-CG1 4.11Å; D318-I321 PolarHBondContact O-N 2.92Å; D318-I321 VanDerWaalsContact O-N 3.1Å; D318-I321 PolarHBondContact OD1-N 3.38Å; D318-L322 PolarHBondContact O-N 2.93Å; D318-L322 VanDerWaalsContact O-N 3.13Å
319	F	98.4	Very high	96.4	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.009	10%	0.101	C	C	.	.	H	α-helix	trans	-64.2	-22.9	179	-80.6	-90.7	0	0	0	112.7	D282 H285 E286 V317 I321 L322 C323 P338 K388 V390	D282-F319 HydrophobicContact CB-CE2 4.39Å; D282-F319 HydrophobicContact CB-CZ 4.06Å; H285-F319 PolarHBondContact O-N 3.42Å; E286-F319 HydrophobicContact CG-CB 4.34Å; V317-F319 HydrophobicContact CB-CD2 4.18Å; V317-F319 HydrophobicContact CB-CE2 3.8Å; V317-F319 HydrophobicContact CB-CZ 4.44Å; V317-F319 HydrophobicContact CG1-CD2 3.89Å; V317-F319 HydrophobicContact CG1-CE2 3.74Å; V317-F319 HydrophobicContact CG1-CG 4.38Å; V317-F319 HydrophobicContact CG1-CZ 4.12Å; V317-F319 WeakPolarHBondContact O-CD2 3.28Å; V317-F319 PolarHBondContact O-N 3.07Å; F319-I321 VanDerWaalsContact C-N 3.32Å; F319-I321 PolarHBondContact O-N 3.45Å; F319-L322 HydrophobicContact CD1-CD2 3.77Å; F319-L322 HydrophobicContact CE1-CD2 3.82Å; F319-L322 PolarHBondContact O-N 2.88Å; F319-C323 WeakPolarHBondContact O-CB 3.26Å; F319-C323 PolarHBondContact O-N 3.01Å; F319-C323 PolarHBondContact O-SG 3Å; F319-P338 HydrophobicContact CB-CB 4.19Å; F319-P338 HydrophobicContact CB-CG 4.15Å; F319-P338 HydrophobicContact CD1-CB 4.04Å; F319-P338 HydrophobicContact CG-CB 4.24Å; F319-K388 HydrophobicContact CD1-CB 4.19Å; F319-K388 HydrophobicContact CD2-CB 3.85Å; F319-K388 HydrophobicContact CD2-CG 3.81Å; F319-K388 HydrophobicContact CE1-CB 3.91Å; F319-K388 HydrophobicContact CE2-CB 3.56Å; F319-K388 HydrophobicContact CE2-CG 3.81Å; F319-K388 HydrophobicContact CG-CB 4.16Å; F319-K388 HydrophobicContact CG-CG 4.38Å; F319-K388 HydrophobicContact CZ-CB 3.6Å; F319-K388 HydrophobicContact CZ-CG 4.37Å; F319-V390 HydrophobicContact CD1-CB 4.48Å; F319-V390 HydrophobicContact CD1-CG2 3.53Å; F319-V390 HydrophobicContact CE1-CB 4.34Å; F319-V390 HydrophobicContact CE1-CG2 3.79Å
320	S	97.6	Very high	96.5	Very high	27 Å²	27	27.4 Å²	27.4	19%	0.189	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-38.2	173.7	78.4	0	0	0	0	111.2	R251 E286 D318 H324	R251-S320 PolarHBondContact NH2-OG 2.8Å; E286-S320 WeakPolarHBondContact O-CB 3.44Å; D318-S320 PolarHBondContact O-N 3.35Å; D318-S320 WeakPolarHBondContact OD1-CA 3.43Å; D318-S320 VanDerWaalsContact OD1-CB 3.25Å; D318-S320 WeakPolarHBondContact OD1-CB 3.39Å; D318-S320 PolarHBondContact OD1-N 2.86Å; D318-S320 PolarHBondContact OD1-OG 3.16Å; S320-H324 WeakPolarHBondContact O-CB 3.48Å; S320-H324 PolarHBondContact O-N 3.28Å
321	I	98.2	Very high	96.9	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-70.9	-45.4	175.3	-61.4	175.9	0	0	0	110.1	V245 V254 V256 M260 I261 D318 F319 C323 H324 A325	V245-I321 HydrophobicContact CG1-CD1 4.34Å; V245-I321 HydrophobicContact CG1-CG1 4.35Å; V245-I321 HydrophobicContact CG2-CD1 3.94Å; V245-I321 HydrophobicContact CG2-CG1 4.47Å; V254-I321 HydrophobicContact CG2-CD1 4.18Å; V256-I321 HydrophobicContact CG2-CD1 4.23Å; M260-I321 HydrophobicContact CE-CB 4.13Å; M260-I321 HydrophobicContact CE-CG2 3.88Å; I261-I321 HydrophobicContact CD1-CG2 3.88Å; I261-I321 HydrophobicContact CG1-CG2 3.99Å; D318-I321 HydrophobicContact CB-CB 4.37Å; D318-I321 HydrophobicContact CB-CD1 3.93Å; D318-I321 HydrophobicContact CB-CG1 4.11Å; D318-I321 PolarHBondContact O-N 2.92Å; D318-I321 VanDerWaalsContact O-N 3.1Å; D318-I321 PolarHBondContact OD1-N 3.38Å; F319-I321 VanDerWaalsContact C-N 3.32Å; F319-I321 PolarHBondContact O-N 3.45Å; I321-C323 PolarHBondContact O-N 3.45Å; I321-H324 PolarHBondContact O-N 2.93Å; I321-A325 PolarHBondContact O-N 3.19Å
322	L	98.6	Very high	97.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.3	-51.8	176.8	-179.9	69.5	0	0	0	111.4	F197 M260 A264 L280 D318 F319 H324 A325 V326 V390	F197-L322 HydrophobicContact CE2-CD1 4.29Å; M260-L322 HydrophobicContact CE-CB 4.2Å; M260-L322 HydrophobicContact CG-CD1 3.69Å; M260-L322 HydrophobicContact SD-CB 4.03Å; M260-L322 HydrophobicContact SD-CD1 4.04Å; A264-L322 HydrophobicContact CB-CD1 3.68Å; L280-L322 HydrophobicContact CD1-CD1 4.24Å; L280-L322 HydrophobicContact CD1-CD2 4.24Å; D318-L322 PolarHBondContact O-N 2.93Å; D318-L322 VanDerWaalsContact O-N 3.13Å; F319-L322 HydrophobicContact CD1-CD2 3.77Å; F319-L322 HydrophobicContact CE1-CD2 3.82Å; F319-L322 PolarHBondContact O-N 2.88Å; L322-H324 VanDerWaalsContact C-N 3.31Å; L322-H324 PolarHBondContact O-N 3.39Å; L322-A325 WeakPolarHBondContact O-CB 3.36Å; L322-A325 PolarHBondContact O-N 3.49Å; L322-V326 WeakPolarHBondContact O-CG2 3.48Å; L322-V326 PolarHBondContact O-N 3.02Å; L322-V390 HydrophobicContact CD2-CB 4.43Å; L322-V390 HydrophobicContact CD2-CG2 4.42Å
323	C	98.5	Very high	97.4	Very high	9 Å²	9	34.9 Å²	34.9	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-36	178.9	-71	0	0	0	0	112.2	F319 I321 V326 K327 L335	F319-C323 WeakPolarHBondContact O-CB 3.26Å; F319-C323 PolarHBondContact O-N 3.01Å; F319-C323 PolarHBondContact O-SG 3Å; I321-C323 PolarHBondContact O-N 3.45Å; C323-V326 PolarHBondContact O-N 3.45Å; C323-K327 WeakPolarHBondContact O-CG 3.34Å; C323-K327 PolarHBondContact O-N 2.94Å; C323-L335 HydrophobicContact CB-CD2 3.62Å
324	H	98.1	Very high	97.4	Very high	61 Å²	61	37.7 Å²	37.7	28%	0.282	19%	0.189	S	C	.	.	H	α-helix	trans	-64.8	-40.8	173.3	-169	73.3	0	0	0	111.7	L244 P246 S320 I321 L322 V326 K327 N328	L244-H324 PolarHBondContact O-CD2 3.07Å; P246-H324 HydrophobicContact CB-CB 4.2Å; P246-H324 HydrophobicContact CG-CB 4.07Å; S320-H324 WeakPolarHBondContact O-CB 3.48Å; S320-H324 PolarHBondContact O-N 3.28Å; I321-H324 PolarHBondContact O-N 2.93Å; L322-H324 VanDerWaalsContact C-N 3.31Å; L322-H324 PolarHBondContact O-N 3.39Å; H324-V326 VanDerWaalsContact C-N 3.34Å; H324-V326 PolarHBondContact O-N 2.95Å; H324-K327 PolarHBondContact O-N 3.05Å; H324-N328 PolarHBondContact CD2-ND2 2.86Å; H324-N328 VanDerWaalsContact CD2-ND2 3.33Å; H324-N328 PolarHBondContact CE1-ND2 3.3Å; H324-N328 PolarHBondContact ND1-ND2 2.8Å; H324-N328 PolarHBondContact NE2-ND2 2.83Å; H324-N328 PolarHBondContact O-N 3.47Å; H324-N328 PolarHBondContact O-ND2 3.47Å
325	A	98.4	Very high	97.4	Very high	6 Å²	6	39.8 Å²	39.8	5%	0.05	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-40.5	176.1	0	0	0	0	0	112.3	I261 A264 Q265 I321 L322 N328 S329	I261-A325 HydrophobicContact CB-CB 4.26Å; I261-A325 HydrophobicContact CG1-CB 4.24Å; I261-A325 HydrophobicContact CG2-CB 3.89Å; A264-A325 HydrophobicContact CB-CB 4.42Å; Q265-A325 WeakPolarHBondContact CG-O 3.29Å; I321-A325 PolarHBondContact O-N 3.19Å; L322-A325 WeakPolarHBondContact O-CB 3.36Å; L322-A325 PolarHBondContact O-N 3.49Å; A325-N328 PolarHBondContact O-N 3.37Å; A325-S329 PolarHBondContact O-N 3.2Å
326	V	98.5	Very high	97.4	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-48	174.6	172.7	0	0	0	0	111.2	A264 L322 C323 H324 N328 S329 V333 L335 I392	A264-V326 HydrophobicContact CB-CG2 4.3Å; L322-V326 WeakPolarHBondContact O-CG2 3.48Å; L322-V326 PolarHBondContact O-N 3.02Å; C323-V326 PolarHBondContact O-N 3.45Å; H324-V326 VanDerWaalsContact C-N 3.34Å; H324-V326 PolarHBondContact O-N 2.95Å; V326-N328 VanDerWaalsContact C-N 3.28Å; V326-N328 PolarHBondContact O-N 2.95Å; V326-S329 VanDerWaalsContact O-CB 3.28Å; V326-S329 WeakPolarHBondContact O-CB 3.4Å; V326-S329 PolarHBondContact O-N 3.37Å; V326-S329 PolarHBondContact O-OG 3.35Å; V326-V333 HydrophobicContact CG1-CG2 4.26Å; V326-L335 HydrophobicContact CB-CD1 4.26Å; V326-L335 HydrophobicContact CG1-CB 4.01Å; V326-L335 HydrophobicContact CG1-CD1 4.02Å; V326-L335 HydrophobicContact CG1-CG 4.43Å; V326-L335 HydrophobicContact CG2-CD1 4.33Å; V326-I392 HydrophobicContact CG1-CD1 4.38Å; V326-I392 HydrophobicContact CG1-CG1 4.33Å; V326-I392 HydrophobicContact CG2-CD1 3.57Å; V326-I392 HydrophobicContact CG2-CG1 4.15Å
327	K	97.4	Very high	97.4	Very high	158 Å²	158	42.1 Å²	42.1	69%	0.687	22%	0.219	S	C	*	.	H	α-helix	trans	-62.8	-31.8	179.8	-71.6	173	-175.8	178.7	0	113.1	C323 H324 L335	C323-K327 WeakPolarHBondContact O-CG 3.34Å; C323-K327 PolarHBondContact O-N 2.94Å; H324-K327 PolarHBondContact O-N 3.05Å; K327-L335 HydrophobicContact CG-CD2 4.27Å
328	N	96.9	Very high	97.4	Very high	82 Å²	82	43.1 Å²	43.1	44%	0.439	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	22.2	178.3	-67.1	-81.8	0	0	0	113.4	H324 A325 V326	H324-N328 PolarHBondContact CD2-ND2 2.86Å; H324-N328 VanDerWaalsContact CD2-ND2 3.33Å; H324-N328 PolarHBondContact CE1-ND2 3.3Å; H324-N328 PolarHBondContact ND1-ND2 2.8Å; H324-N328 PolarHBondContact NE2-ND2 2.83Å; H324-N328 PolarHBondContact O-N 3.47Å; H324-N328 PolarHBondContact O-ND2 3.47Å; A325-N328 PolarHBondContact O-N 3.37Å; V326-N328 VanDerWaalsContact C-N 3.28Å; V326-N328 PolarHBondContact O-N 2.95Å
329	S	97.2	Very high	97.4	Very high	7 Å²	7	44 Å²	44	5%	0.049	23%	0.231	C	C	.	.	S	Bend	trans	-84.6	-6.6	-178.6	66.1	0	0	0	0	114.6	C268 A325 V326 A331	C268-S329 WeakPolarHBondContact CB-OG 3.5Å; A325-S329 PolarHBondContact O-N 3.2Å; V326-S329 VanDerWaalsContact O-CB 3.28Å; V326-S329 WeakPolarHBondContact O-CB 3.4Å; V326-S329 PolarHBondContact O-N 3.37Å; V326-S329 PolarHBondContact O-OG 3.35Å; S329-A331 PolarHBondContact O-N 3.35Å; S329-A331 WeakPolarHBondContact OG-CB 3.25Å; S329-A331 PolarHBondContact OG-N 3.43Å
330	D	95	Very high	97.3	Very high	164 Å²	164	45.5 Å²	45.5	88%	0.877	24%	0.241	S	C	*	.			trans	55.7	8.1	-169.5	-59.1	-42.1	0	0	0	114.9
331	A	97.2	Very high	97.3	Very high	17 Å²	17	44.2 Å²	44.2	14%	0.14	23%	0.232	C	C	.	.	S	Bend	trans	-90.5	143	-178.7	0	0	0	0	0	110.9	C268 N272 S329 V333	C268-A331 HydrophobicContact CB-CB 3.83Å; N272-A331 HydrophobicContact CB-CB 3.8Å; S329-A331 PolarHBondContact O-N 3.35Å; S329-A331 WeakPolarHBondContact OG-CB 3.25Å; S329-A331 PolarHBondContact OG-N 3.43Å; A331-V333 VanDerWaalsContact C-N 3.27Å; A331-V333 HydrophobicContact CB-CG1 4.25Å; A331-V333 HydrophobicContact CB-CG2 4.43Å; A331-V333 PolarHBondContact O-N 2.68Å
332	K	95.7	Very high	97.3	Very high	143 Å²	143	44.1 Å²	44.1	62%	0.622	23%	0.231	S	C	*	.	S	Bend	trans	-78.2	79.4	174.6	-60.7	-178.1	176.6	-174.8	0	110.6	N272 E395	N272-K332 WeakPolarHBondContact OD1-CB 3.45Å; N272-K332 PolarHBondContact OD1-N 2.97Å; K332-E395 HydrophobicContact CB-CB 4.44Å; K332-E395 PolarHBondContact O-N 2.94Å
333	V	96.7	Very high	97.2	Very high	26 Å²	26	46 Å²	46	16%	0.158	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.6	178.5	-61.5	0	0	0	0	110.1	C268 I271 N272 V326 A331 I392 T393	C268-V333 HydrophobicContact CB-CG1 4.49Å; C268-V333 HydrophobicContact CB-CG2 4.12Å; I271-V333 HydrophobicContact CB-CG1 4.14Å; I271-V333 HydrophobicContact CG2-CG1 3.91Å; N272-V333 HydrophobicContact CB-CG1 4.18Å; V326-V333 HydrophobicContact CG1-CG2 4.26Å; A331-V333 VanDerWaalsContact C-N 3.27Å; A331-V333 HydrophobicContact CB-CG1 4.25Å; A331-V333 HydrophobicContact CB-CG2 4.43Å; A331-V333 PolarHBondContact O-N 2.68Å; V333-I392 HydrophobicContact CB-CG2 3.79Å; V333-I392 HydrophobicContact CG1-CG2 4.21Å; V333-I392 HydrophobicContact CG2-CG2 3.87Å; V333-T393 CarbonylContact C-O 3.57Å; V333-T393 VanDerWaalsContact CA-O 3.3Å; V333-T393 WeakPolarHBondContact CA-O 3.38Å; V333-T393 WeakPolarHBondContact CB-O 3.44Å
334	R	95.7	Very high	97.2	Very high	61 Å²	61	45.6 Å²	45.6	23%	0.23	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	138.2	169.9	-67.4	-164.8	-179.3	123.9	19.9	110.7	I392 T393 E395 D399	R334-I392 VanDerWaalsContact O-CA 3.32Å; R334-I392 WeakPolarHBondContact O-CA 3.4Å; R334-T393 PolarHBondContact N-O 2.87Å; R334-T393 PolarHBondContact O-N 3.27Å; R334-E395 IonicContact NH2-OE1 3.75Å; R334-D399 IonicContact CZ-OD2 3.63Å; R334-D399 VanDerWaalsContact NH1-CB 3.29Å; R334-D399 IonicContact NH1-OD1 3.49Å; R334-D399 IonicContact NH1-OD2 2.72Å; R334-D399 PolarHBondContact NH1-OD2 3.44Å; R334-D399 IonicContact NH2-OD2 2.77Å; R334-D399 PolarHBondContact NH2-OD2 3.17Å
335	L	97.2	Very high	97.2	Very high	44 Å²	44	42.7 Å²	42.7	23%	0.23	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127	174	175.1	69.8	0	0	0	108.6	C323 V326 K327 V390	C323-L335 HydrophobicContact CB-CD2 3.62Å; V326-L335 HydrophobicContact CB-CD1 4.26Å; V326-L335 HydrophobicContact CG1-CB 4.01Å; V326-L335 HydrophobicContact CG1-CD1 4.02Å; V326-L335 HydrophobicContact CG1-CG 4.43Å; V326-L335 HydrophobicContact CG2-CD1 4.33Å; K327-L335 HydrophobicContact CG-CD2 4.27Å; L335-V390 HydrophobicContact CD1-CG1 3.44Å; L335-V390 VanDerWaalsContact CD1-CG1 3.44Å
336	H	97.2	Very high	97.1	Very high	24 Å²	24	43 Å²	43	11%	0.111	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.4	173.2	-53.3	-96.3	0	0	0	109.4	V390 A391 T393 L407 F410	H336-V390 WeakPolarHBondContact O-CA 3.37Å; H336-A391 HydrophobicContact CB-CB 4.22Å; H336-A391 PolarHBondContact N-O 3.09Å; H336-A391 PolarHBondContact O-N 2.74Å; H336-T393 PolarHBondContact NE2-OG1 3.36Å; H336-L407 HydrophobicContact CB-CD2 3.96Å; H336-F410 HydrophobicContact CB-CB 4.18Å; H336-F410 HydrophobicContact CB-CD1 3.69Å; H336-F410 HydrophobicContact CB-CD2 4.33Å; H336-F410 HydrophobicContact CB-CE1 4.11Å; H336-F410 HydrophobicContact CB-CG 3.8Å; H336-F410 WeakPolarHBondContact O-CE1 3.48Å
337	G	96.6	Very high	97	Very high	34 Å²	34	43.1 Å²	43.1	35%	0.351	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	85.8	-164.4	-174.6	0	0	0	0	0	114.3
338	P	97.9	Very high	97	Very high	28 Å²	28	36.7 Å²	36.7	18%	0.182	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-68.1	144.8	7.5	30.6	-35.9	0	0	0	112.7	E286 F319 K388 F389 V390	E286-P338 VanDerWaalsContact CD-CG 3.42Å; E286-P338 HydrophobicContact CG-CG 3.83Å; E286-P338 WeakPolarHBondContact OE2-CG 3.39Å; F319-P338 HydrophobicContact CB-CB 4.19Å; F319-P338 HydrophobicContact CB-CG 4.15Å; F319-P338 HydrophobicContact CD1-CB 4.04Å; F319-P338 HydrophobicContact CG-CB 4.24Å; P338-K388 HydrophobicContact CB-CB 4.21Å; P338-F389 VanDerWaalsContact CA-O 3.29Å; P338-F389 WeakPolarHBondContact CA-O 3.45Å; P338-V390 HydrophobicContact CB-CG2 3.84Å
339	V	97.7	Very high	96.9	Very high	24 Å²	24	33.4 Å²	33.4	15%	0.145	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	159.4	167.2	-61.8	0	0	0	0	109.4	Y343 F344 K388 F389 F410	V339-Y343 HydrophobicContact CB-CD1 3.68Å; V339-Y343 HydrophobicContact CB-CE1 4.27Å; V339-Y343 HydrophobicContact CB-CG 4.2Å; V339-Y343 HydrophobicContact CG1-CD1 3.91Å; V339-Y343 HydrophobicContact CG1-CE1 3.98Å; V339-Y343 HydrophobicContact CG2-CD1 3.92Å; V339-F344 HydrophobicContact CG2-CB 4.09Å; V339-K388 CarbonylContact O-C 3.55Å; V339-K388 VanDerWaalsContact O-CA 3.22Å; V339-K388 WeakPolarHBondContact O-CA 3.49Å; V339-F389 HydrophobicContact CG2-CB 3.96Å; V339-F389 PolarHBondContact N-O 2.66Å; V339-F389 PolarHBondContact O-N 3.37Å; V339-F410 HydrophobicContact CG1-CD1 4.11Å; V339-F410 HydrophobicContact CG2-CD1 3.76Å; V339-F410 HydrophobicContact CG2-CE1 3.81Å
340	T	97.8	Very high	96.9	Very high	35 Å²	35	33.1 Å²	33.1	22%	0.215	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	156.1	177.7	70	0	0	0	0	111.7	A342 Y343 F344 G384 F387 K388	T340-A342 VanDerWaalsContact C-N 3.29Å; T340-A342 PolarHBondContact O-N 3.45Å; T340-Y343 WeakPolarHBondContact O-CB 3.03Å; T340-Y343 PolarHBondContact O-N 3.09Å; T340-Y343 VanDerWaalsContact OG1-CB 3.3Å; T340-Y343 WeakPolarHBondContact OG1-CB 3.47Å; T340-Y343 PolarHBondContact OG1-N 3.39Å; T340-Y343 VanDerWaalsContact OG1-N 3.17Å; T340-F344 PolarHBondContact O-N 3.45Å; T340-G384 VanDerWaalsContact CB-O 3.27Å; T340-G384 WeakPolarHBondContact CB-O 3.4Å; T340-F387 CarbonylContact C-O 3.54Å; T340-F387 WeakPolarHBondContact CA-O 3.43Å; T340-K388 HydrophobicContact CG2-CD 4.41Å
341	Q	97.6	Very high	96.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-42.9	174.6	177.1	167.1	-76.9	0	0	111.9	S84 F91 Y343 F344 L345 L377 G384 F387 F389	S84-Q341 PolarHBondContact OG-NE2 3.47Å; S84-Q341 PolarHBondContact OG-OE1 2.9Å; F91-Q341 HydrophobicContact CE2-CG 4.49Å; Q341-Y343 VanDerWaalsContact C-N 3.33Å; Q341-Y343 PolarHBondContact O-N 3.16Å; Q341-F344 PolarHBondContact O-N 2.96Å; Q341-L345 HydrophobicContact CG-CD1 3.54Å; Q341-L345 HydrophobicContact CG-CG 4.08Å; Q341-L345 WeakPolarHBondContact O-CB 3.35Å; Q341-L345 VanDerWaalsContact O-CG 3.29Å; Q341-L345 WeakPolarHBondContact O-CG 3.33Å; Q341-L345 PolarHBondContact O-N 3.35Å; Q341-L377 PolarHBondContact NE2-O 2.9Å; Q341-G384 PolarHBondContact N-O 3.19Å; Q341-F387 HydrophobicContact CB-CB 3.67Å; Q341-F387 HydrophobicContact CG-CB 4.42Å; Q341-F387 PolarHBondContact N-O 2.64Å; Q341-F389 HydrophobicContact CB-CD2 4.08Å; Q341-F389 HydrophobicContact CB-CE2 3.63Å; Q341-F389 HydrophobicContact CG-CE2 3.65Å; Q341-F389 HydrophobicContact CG-CZ 4.27Å
342	A	97	Very high	96.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.2	-48.2	175.5	0	0	0	0	0	111.3	T340 F344 I346 V378 G384	T340-A342 VanDerWaalsContact C-N 3.29Å; T340-A342 PolarHBondContact O-N 3.45Å; A342-F344 PolarHBondContact O-N 3.35Å; A342-I346 WeakPolarHBondContact O-CB 3.45Å; A342-I346 WeakPolarHBondContact O-CD1 3.28Å; A342-I346 WeakPolarHBondContact O-CG1 3.17Å; A342-I346 PolarHBondContact O-N 2.79Å; A342-V378 HydrophobicContact CB-CB 4.13Å; A342-V378 WeakPolarHBondContact CB-O 3.44Å; A342-G384 WeakPolarHBondContact CB-O 3.33Å; A342-G384 PolarHBondContact N-O 3.12Å
343	Y	97.3	Very high	96.7	Very high	40 Å²	40	31.2 Å²	31.2	16%	0.157	17%	0.167	C	C	.	.	H	α-helix	trans	-58.1	-50.8	177.9	-177.4	-79.3	0	0	0	111.3	V339 T340 Q341 N347 G409 P412 Y418	V339-Y343 HydrophobicContact CB-CD1 3.68Å; V339-Y343 HydrophobicContact CB-CE1 4.27Å; V339-Y343 HydrophobicContact CB-CG 4.2Å; V339-Y343 HydrophobicContact CG1-CD1 3.91Å; V339-Y343 HydrophobicContact CG1-CE1 3.98Å; V339-Y343 HydrophobicContact CG2-CD1 3.92Å; T340-Y343 WeakPolarHBondContact O-CB 3.03Å; T340-Y343 PolarHBondContact O-N 3.09Å; T340-Y343 VanDerWaalsContact OG1-CB 3.3Å; T340-Y343 WeakPolarHBondContact OG1-CB 3.47Å; T340-Y343 PolarHBondContact OG1-N 3.39Å; T340-Y343 VanDerWaalsContact OG1-N 3.17Å; Q341-Y343 VanDerWaalsContact C-N 3.33Å; Q341-Y343 PolarHBondContact O-N 3.16Å; Y343-N347 WeakPolarHBondContact CD1-ND2 3.48Å; Y343-N347 WeakPolarHBondContact CE1-ND2 3.33Å; Y343-N347 VanDerWaalsContact CZ-ND2 3.33Å; Y343-N347 WeakPolarHBondContact O-CB 3.5Å; Y343-N347 PolarHBondContact O-N 2.99Å; Y343-N347 PolarHBondContact O-ND2 3.42Å; Y343-G409 VanDerWaalsContact CD1-O 3.31Å; Y343-G409 WeakPolarHBondContact CD1-O 3.16Å; Y343-G409 VanDerWaalsContact CE1-O 3.3Å; Y343-G409 WeakPolarHBondContact CE1-O 3.25Å; Y343-P412 WeakPolarHBondContact OH-CD 3.41Å; Y343-P412 VanDerWaalsContact OH-CG 3.27Å; Y343-P412 WeakPolarHBondContact OH-CG 3.3Å; Y343-Y418 AromaticContact CD2-CD1 3.51Å; Y343-Y418 HydrophobicContact CD2-CD1 3.51Å; Y343-Y418 AromaticContact CD2-CD2 3.95Å; Y343-Y418 HydrophobicContact CD2-CD2 3.95Å; Y343-Y418 AromaticContact CD2-CE1 3.88Å; Y343-Y418 HydrophobicContact CD2-CE1 3.88Å; Y343-Y418 HydrophobicContact CD2-CE2 4.29Å; Y343-Y418 AromaticContact CD2-CG 3.54Å; Y343-Y418 HydrophobicContact CD2-CG 3.54Å; Y343-Y418 AromaticContact CE2-CD1 4Å; Y343-Y418 HydrophobicContact CE2-CD1 4Å; Y343-Y418 HydrophobicContact CE2-CD2 4.47Å; Y343-Y418 AromaticContact CE2-CG 3.82Å; Y343-Y418 HydrophobicContact CE2-CG 3.82Å; Y343-Y418 HydrophobicContact CG-CD2 4.47Å; Y343-Y418 HydrophobicContact CG-CG 4.46Å
344	F	98	Very high	96.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-53.2	-178.1	-178.9	-89.7	0	0	0	111.9	I95 W98 L279 V339 T340 Q341 A342 I346 N347 M348 F389 G409 F410	I95-F344 HydrophobicContact CD1-CE1 3.89Å; I95-F344 HydrophobicContact CD1-CZ 4.48Å; W98-F344 HydrophobicContact CB-CZ 4.26Å; W98-F344 AromaticContact CD1-CE2 3.89Å; W98-F344 AromaticContact CD1-CZ 3.74Å; W98-F344 HydrophobicContact CG-CE2 4.5Å; W98-F344 AromaticContact CG-CZ 3.97Å; W98-F344 HydrophobicContact CG-CZ 3.97Å; L279-F344 HydrophobicContact CD1-CE2 4.4Å; L279-F344 HydrophobicContact CD2-CZ 4.22Å; V339-F344 HydrophobicContact CG2-CB 4.09Å; T340-F344 PolarHBondContact O-N 3.45Å; Q341-F344 PolarHBondContact O-N 2.96Å; A342-F344 PolarHBondContact O-N 3.35Å; F344-I346 PolarHBondContact O-N 3.35Å; F344-N347 PolarHBondContact O-N 3.23Å; F344-M348 HydrophobicContact CD1-CG 4.06Å; F344-M348 HydrophobicContact CE1-CG 3.64Å; F344-M348 HydrophobicContact CE2-CG 4.22Å; F344-M348 HydrophobicContact CZ-CG 3.73Å; F344-M348 HydrophobicContact CZ-SD 4.31Å; F344-M348 WeakPolarHBondContact O-CB 3.44Å; F344-M348 VanDerWaalsContact O-CG 3.31Å; F344-M348 WeakPolarHBondContact O-CG 3.21Å; F344-M348 PolarHBondContact O-N 2.81Å; F344-F389 HydrophobicContact CB-CB 4.24Å; F344-F389 HydrophobicContact CB-CD1 3.89Å; F344-F389 HydrophobicContact CB-CD2 4.26Å; F344-F389 HydrophobicContact CB-CE1 4.3Å; F344-F389 HydrophobicContact CB-CG 3.87Å; F344-F389 AromaticContact CD1-CD1 3.4Å; F344-F389 HydrophobicContact CD1-CD1 3.4Å; F344-F389 AromaticContact CD1-CE1 3.21Å; F344-F389 HydrophobicContact CD1-CE1 3.21Å; F344-F389 HydrophobicContact CD1-CG 4.23Å; F344-F389 AromaticContact CD1-CZ 3.94Å; F344-F389 HydrophobicContact CD1-CZ 3.94Å; F344-F389 HydrophobicContact CD2-CB 4.28Å; F344-F389 AromaticContact CD2-CD1 3.65Å; F344-F389 HydrophobicContact CD2-CD1 3.65Å; F344-F389 HydrophobicContact CD2-CE1 4.33Å; F344-F389 HydrophobicContact CD2-CG 4.21Å; F344-F389 AromaticContact CE1-CD1 3.77Å; F344-F389 HydrophobicContact CE1-CD1 3.77Å; F344-F389 AromaticContact CE1-CE1 3.48Å; F344-F389 HydrophobicContact CE1-CE1 3.48Å; F344-F389 VanDerWaalsContact CE1-CE1 3.48Å; F344-F389 HydrophobicContact CE1-CZ 4.47Å; F344-F389 HydrophobicContact CE2-CD1 4.01Å; F344-F389 HydrophobicContact CG-CB 4.31Å; F344-F389 AromaticContact CG-CD1 3.33Å; F344-F389 HydrophobicContact CG-CD1 3.33Å; F344-F389 AromaticContact CG-CE1 3.69Å; F344-F389 HydrophobicContact CG-CE1 3.69Å; F344-F389 AromaticContact CG-CG 3.83Å; F344-F389 HydrophobicContact CG-CG 3.83Å; F344-F389 HydrophobicContact CG-CZ 4.45Å; F344-F389 HydrophobicContact CZ-CD1 4.05Å; F344-F389 HydrophobicContact CZ-CE1 4.16Å; F344-G409 WeakPolarHBondContact CA-O 3.43Å; F344-F410 HydrophobicContact CD2-CD2 4.06Å; F344-F410 AromaticContact CD2-CE2 3.74Å; F344-F410 HydrophobicContact CD2-CE2 3.74Å; F344-F410 HydrophobicContact CD2-CZ 4.06Å; F344-F410 AromaticContact CE2-CD2 3.88Å; F344-F410 HydrophobicContact CE2-CD2 3.88Å; F344-F410 AromaticContact CE2-CE2 3.42Å; F344-F410 HydrophobicContact CE2-CE2 3.42Å; F344-F410 VanDerWaalsContact CE2-CE2 3.42Å; F344-F410 HydrophobicContact CE2-CZ 4.09Å
345	L	97.7	Very high	96.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.7	-41.2	-175.4	-63.8	174.5	0	0	0	112	F91 L94 Q341 M348 G349 L350 L377 V378	F91-L345 HydrophobicContact CD2-CD1 4.03Å; F91-L345 HydrophobicContact CD2-CD2 3.93Å; F91-L345 HydrophobicContact CE2-CD1 4.49Å; F91-L345 HydrophobicContact CE2-CD2 4.33Å; L94-L345 HydrophobicContact CB-CD2 4.43Å; L94-L345 HydrophobicContact CD1-CB 4.29Å; L94-L345 HydrophobicContact CD1-CD2 3.98Å; Q341-L345 HydrophobicContact CG-CD1 3.54Å; Q341-L345 HydrophobicContact CG-CG 4.08Å; Q341-L345 WeakPolarHBondContact O-CB 3.35Å; Q341-L345 VanDerWaalsContact O-CG 3.29Å; Q341-L345 WeakPolarHBondContact O-CG 3.33Å; Q341-L345 PolarHBondContact O-N 3.35Å; L345-M348 PolarHBondContact O-N 2.68Å; L345-G349 PolarHBondContact O-N 2.98Å; L345-L350 HydrophobicContact CB-CB 4.26Å; L345-L350 HydrophobicContact CB-CD1 3.71Å; L345-L350 HydrophobicContact CD1-CD1 4.1Å; L345-L350 HydrophobicContact CG-CD1 4.48Å; L345-L350 WeakPolarHBondContact O-CB 3.34Å; L345-L350 PolarHBondContact O-N 3.07Å; L345-L377 HydrophobicContact CD1-CB 3.96Å; L345-L377 HydrophobicContact CD1-CD1 4.27Å; L345-V378 HydrophobicContact CD1-CG1 4.42Å
346	I	96.7	Very high	96.6	Very high	12 Å²	12	35.9 Å²	35.9	6%	0.062	19%	0.19	C	C	.	.	H	α-helix	trans	-62.9	-46.1	177.6	-72	168.9	0	0	0	110.4	A342 F344 M348 G349 F351 V378 T416 Y418	A342-I346 WeakPolarHBondContact O-CB 3.45Å; A342-I346 WeakPolarHBondContact O-CD1 3.28Å; A342-I346 WeakPolarHBondContact O-CG1 3.17Å; A342-I346 PolarHBondContact O-N 2.79Å; F344-I346 PolarHBondContact O-N 3.35Å; I346-M348 VanDerWaalsContact C-N 3.26Å; I346-M348 PolarHBondContact O-N 3.1Å; I346-G349 PolarHBondContact O-N 2.53Å; I346-F351 HydrophobicContact CB-CE2 4.47Å; I346-F351 HydrophobicContact CD1-CE2 4.06Å; I346-F351 HydrophobicContact CD1-CZ 4.02Å; I346-F351 HydrophobicContact CG1-CE2 3.84Å; I346-F351 HydrophobicContact CG1-CZ 4.02Å; I346-F351 HydrophobicContact CG2-CD2 4.31Å; I346-F351 HydrophobicContact CG2-CE2 3.91Å; I346-V378 HydrophobicContact CD1-CB 4.46Å; I346-V378 HydrophobicContact CG1-CG1 4.43Å; I346-T416 HydrophobicContact CG2-CG2 3.83Å; I346-Y418 HydrophobicContact CB-CD2 4.34Å; I346-Y418 HydrophobicContact CB-CE2 3.9Å; I346-Y418 HydrophobicContact CD1-CE2 3.72Å; I346-Y418 HydrophobicContact CG1-CE2 4.38Å; I346-Y418 HydrophobicContact CG2-CD2 3.97Å; I346-Y418 HydrophobicContact CG2-CE2 3.89Å
347	N	96.6	Very high	96.5	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-73.9	-15.7	178.7	-69.8	-47.8	0	0	0	113.5	Y343 F344 G349 L413 T416	Y343-N347 WeakPolarHBondContact CD1-ND2 3.48Å; Y343-N347 WeakPolarHBondContact CE1-ND2 3.33Å; Y343-N347 VanDerWaalsContact CZ-ND2 3.33Å; Y343-N347 WeakPolarHBondContact O-CB 3.5Å; Y343-N347 PolarHBondContact O-N 2.99Å; Y343-N347 PolarHBondContact O-ND2 3.42Å; F344-N347 PolarHBondContact O-N 3.23Å; N347-G349 VanDerWaalsContact C-N 3.28Å; N347-L413 HydrophobicContact CB-CB 4.38Å; N347-L413 PolarHBondContact OD1-N 3.05Å; N347-T416 PolarHBondContact OD1-OG1 3.3Å
348	M	96.6	Very high	96.4	Very high	22 Å²	22	36 Å²	36	11%	0.108	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.4	165.9	-76	-58.5	-57.6	0	0	113.5	L94 V97 W98 F344 L345 I346 P408	L94-M348 HydrophobicContact CB-CB 4.25Å; L94-M348 HydrophobicContact CD1-CB 4.11Å; L94-M348 HydrophobicContact CD2-CB 4.2Å; L94-M348 WeakPolarHBondContact CD2-O 3.2Å; L94-M348 HydrophobicContact CG-CB 4.42Å; V97-M348 HydrophobicContact CB-CE 4.29Å; V97-M348 HydrophobicContact CG1-CE 4.03Å; W98-M348 HydrophobicContact CB-CE 3.72Å; W98-M348 HydrophobicContact CB-SD 4.26Å; F344-M348 HydrophobicContact CD1-CG 4.06Å; F344-M348 HydrophobicContact CE1-CG 3.64Å; F344-M348 HydrophobicContact CE2-CG 4.22Å; F344-M348 HydrophobicContact CZ-CG 3.73Å; F344-M348 HydrophobicContact CZ-SD 4.31Å; F344-M348 WeakPolarHBondContact O-CB 3.44Å; F344-M348 VanDerWaalsContact O-CG 3.31Å; F344-M348 WeakPolarHBondContact O-CG 3.21Å; F344-M348 PolarHBondContact O-N 2.81Å; L345-M348 PolarHBondContact O-N 2.68Å; I346-M348 VanDerWaalsContact C-N 3.26Å; I346-M348 PolarHBondContact O-N 3.1Å; M348-P408 VanDerWaalsContact SD-C 3.55Å; M348-P408 HydrophobicContact SD-CB 3.59Å; M348-P408 VanDerWaalsContact SD-CB 3.59Å
349	G	95.7	Very high	96.3	Very high	13 Å²	13	39.2 Å²	39.2	13%	0.134	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	29.8	175.6	0	0	0	0	0	115	L345 I346 N347 F351 T352 R353	L345-G349 PolarHBondContact O-N 2.98Å; I346-G349 PolarHBondContact O-N 2.53Å; N347-G349 VanDerWaalsContact C-N 3.28Å; G349-F351 VanDerWaalsContact C-N 3.31Å; G349-F351 PolarHBondContact O-N 3.44Å; G349-T352 WeakPolarHBondContact O-CB 3.36Å; G349-T352 PolarHBondContact O-N 3.13Å; G349-T352 VanDerWaalsContact O-N 3.1Å; G349-R353 PolarHBondContact O-N 2.86Å
350	L	96.2	Very high	96.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-48.6	-47.6	177.4	178.5	146.1	0	0	0	113.2	I90 L94 L345 T352 R353 L354 V378	I90-L350 HydrophobicContact CG2-CD1 4.43Å; I90-L350 HydrophobicContact CG2-CG 4.21Å; L94-L350 HydrophobicContact CD1-CB 3.89Å; L345-L350 HydrophobicContact CB-CB 4.26Å; L345-L350 HydrophobicContact CB-CD1 3.71Å; L345-L350 HydrophobicContact CD1-CD1 4.1Å; L345-L350 HydrophobicContact CG-CD1 4.48Å; L345-L350 WeakPolarHBondContact O-CB 3.34Å; L345-L350 PolarHBondContact O-N 3.07Å; L350-T352 VanDerWaalsContact C-N 3.33Å; L350-T352 PolarHBondContact O-N 2.62Å; L350-R353 PolarHBondContact O-N 3.34Å; L350-L354 VanDerWaalsContact O-CB 3.3Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 PolarHBondContact O-N 2.73Å; L350-V378 HydrophobicContact CD1-CG1 3.63Å; L350-V378 HydrophobicContact CD2-CG1 4.36Å
351	F	94.4	Very high	95.9	Very high	109 Å²	109	44.9 Å²	44.9	48%	0.478	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-37.5	-178.6	-63.6	-51.1	0	0	0	112.9	I346 G349 K355	I346-F351 HydrophobicContact CB-CE2 4.47Å; I346-F351 HydrophobicContact CD1-CE2 4.06Å; I346-F351 HydrophobicContact CD1-CZ 4.02Å; I346-F351 HydrophobicContact CG1-CE2 3.84Å; I346-F351 HydrophobicContact CG1-CZ 4.02Å; I346-F351 HydrophobicContact CG2-CD2 4.31Å; I346-F351 HydrophobicContact CG2-CE2 3.91Å; G349-F351 VanDerWaalsContact C-N 3.31Å; G349-F351 PolarHBondContact O-N 3.44Å; F351-K355 WeakPolarHBondContact O-CB 3.49Å; F351-K355 PolarHBondContact O-N 3.36Å
352	T	95	Very high	95.8	Very high	101 Å²	101	53.7 Å²	53.7	62%	0.62	27%	0.27	S	S	*	.	H	α-helix	trans	-63.3	-45.2	175.1	-59.2	0	0	0	0	110.5	G349 L350 K355 V356	G349-T352 WeakPolarHBondContact O-CB 3.36Å; G349-T352 PolarHBondContact O-N 3.13Å; G349-T352 VanDerWaalsContact O-N 3.1Å; L350-T352 VanDerWaalsContact C-N 3.33Å; L350-T352 PolarHBondContact O-N 2.62Å; T352-K355 PolarHBondContact O-N 2.8Å; T352-V356 WeakPolarHBondContact O-CG2 3.49Å; T352-V356 PolarHBondContact O-N 3.4Å
353	R	95.5	Very high	95.7	Very high	75 Å²	75	55.8 Å²	55.8	28%	0.283	29%	0.285	S	S	.	.	H	α-helix	trans	-67.2	-44.1	178.8	-178.1	54.5	-178.1	171.4	-0.5	112.1	I90 E93 G349 L350 K355 V356 L357	I90-R353 HydrophobicContact CD1-CG 4.18Å; I90-R353 HydrophobicContact CG1-CG 4.04Å; I90-R353 HydrophobicContact CG2-CB 4.23Å; I90-R353 HydrophobicContact CG2-CG 4.01Å; E93-R353 VanDerWaalsContact CD-NH2 3.29Å; E93-R353 IonicContact OE1-CZ 3.55Å; E93-R353 IonicContact OE1-NE 3.71Å; E93-R353 IonicContact OE1-NH2 2.67Å; E93-R353 PolarHBondContact OE1-NH2 3.04Å; E93-R353 IonicContact OE2-CZ 3.27Å; E93-R353 VanDerWaalsContact OE2-CZ 3.27Å; E93-R353 IonicContact OE2-NE 2.64Å; E93-R353 PolarHBondContact OE2-NE 3.44Å; E93-R353 IonicContact OE2-NH2 3.17Å; E93-R353 PolarHBondContact OE2-NH2 3.3Å; G349-R353 PolarHBondContact O-N 2.86Å; L350-R353 PolarHBondContact O-N 3.34Å; R353-K355 VanDerWaalsContact C-N 3.32Å; R353-K355 PolarHBondContact O-N 3.45Å; R353-V356 PolarHBondContact O-N 2.83Å; R353-V356 VanDerWaalsContact O-N 3.14Å; R353-L357 HydrophobicContact CG-CD1 4.36Å; R353-L357 PolarHBondContact O-N 2.87Å; R353-L357 VanDerWaalsContact O-N 3.08Å
354	L	95.8	Very high	95.6	Very high	11 Å²	11	59.3 Å²	59.3	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-56.2	-47.2	176.4	176.8	56.7	0	0	0	110.8	I90 L350 V356 L357 L358 L370 F371 C374	I90-L354 HydrophobicContact CD1-CB 3.87Å; I90-L354 HydrophobicContact CD1-CD1 4.15Å; L350-L354 VanDerWaalsContact O-CB 3.3Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 PolarHBondContact O-N 2.73Å; L354-V356 VanDerWaalsContact C-N 3.29Å; L354-V356 PolarHBondContact O-N 3.2Å; L354-L357 PolarHBondContact O-N 3.46Å; L354-L357 VanDerWaalsContact O-N 3.1Å; L354-L358 HydrophobicContact CD1-CD1 3.88Å; L354-L358 HydrophobicContact CD1-CD2 4.27Å; L354-L358 HydrophobicContact CD1-CG 3.81Å; L354-L358 HydrophobicContact CG-CD1 3.78Å; L354-L358 HydrophobicContact CG-CG 4.2Å; L354-L358 WeakPolarHBondContact O-CB 3.24Å; L354-L358 VanDerWaalsContact O-CG 3.31Å; L354-L358 WeakPolarHBondContact O-CG 3.36Å; L354-L358 PolarHBondContact O-N 3.43Å; L354-L370 HydrophobicContact CD1-CD2 3.84Å; L354-L370 HydrophobicContact CD1-CG 3.72Å; L354-F371 HydrophobicContact CD2-CD2 4.29Å; L354-C374 HydrophobicContact CD2-CB 4.1Å
355	K	95.5	Very high	95.4	Very high	161 Å²	161	65.4 Å²	65.4	70%	0.7	33%	0.331	S	S	*	.	H	α-helix	trans	-56.7	-40	176.9	-174.3	178.1	-178.3	178.2	0	113.1	F351 T352 R353 S359	F351-K355 WeakPolarHBondContact O-CB 3.49Å; F351-K355 PolarHBondContact O-N 3.36Å; T352-K355 PolarHBondContact O-N 2.8Å; R353-K355 VanDerWaalsContact C-N 3.32Å; R353-K355 PolarHBondContact O-N 3.45Å; K355-S359 PolarHBondContact O-N 3.01Å
356	V	96	Very high	95.1	Very high	57 Å²	57	69.2 Å²	69.2	35%	0.345	35%	0.349	S	S	.	.	H	α-helix	trans	-70.1	-34.1	178.3	172.3	0	0	0	0	112.2	T352 R353 L354 S359 K360	T352-V356 WeakPolarHBondContact O-CG2 3.49Å; T352-V356 PolarHBondContact O-N 3.4Å; R353-V356 PolarHBondContact O-N 2.83Å; R353-V356 VanDerWaalsContact O-N 3.14Å; L354-V356 VanDerWaalsContact C-N 3.29Å; L354-V356 PolarHBondContact O-N 3.2Å; V356-S359 PolarHBondContact O-OG 3.01Å; V356-K360 WeakPolarHBondContact O-CG 3.48Å
357	L	94.5	Very high	95	Very high	19 Å²	19	71.9 Å²	71.9	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-76.5	-42.7	177.7	-72.8	175.1	0	0	0	111.5	Q89 I90 R353 L354 S359 K360 C361 L370	Q89-L357 HydrophobicContact CG-CD1 4.26Å; I90-L357 HydrophobicContact CD1-CD1 3.73Å; I90-L357 HydrophobicContact CG1-CD1 3.48Å; I90-L357 VanDerWaalsContact CG1-CD1 3.48Å; R353-L357 HydrophobicContact CG-CD1 4.36Å; R353-L357 PolarHBondContact O-N 2.87Å; R353-L357 VanDerWaalsContact O-N 3.08Å; L354-L357 PolarHBondContact O-N 3.46Å; L354-L357 VanDerWaalsContact O-N 3.1Å; L357-S359 PolarHBondContact O-N 3.39Å; L357-K360 WeakPolarHBondContact O-CB 3.41Å; L357-K360 PolarHBondContact O-N 3.26Å; L357-C361 PolarHBondContact O-N 3.44Å; L357-C361 PolarHBondContact O-SG 2.83Å; L357-L370 HydrophobicContact CB-CD2 3.5Å; L357-L370 HydrophobicContact CD1-CD2 4.36Å
358	L	94.8	Very high	94.9	Very high	42 Å²	42	75.8 Å²	75.8	22%	0.22	38%	0.381	C	S	.	.	H	α-helix	trans	-58.3	-34.7	176	-71	172.7	0	0	0	112.6	L354 K360 C361 K367 L370	L354-L358 HydrophobicContact CD1-CD1 3.88Å; L354-L358 HydrophobicContact CD1-CD2 4.27Å; L354-L358 HydrophobicContact CD1-CG 3.81Å; L354-L358 HydrophobicContact CG-CD1 3.78Å; L354-L358 HydrophobicContact CG-CG 4.2Å; L354-L358 WeakPolarHBondContact O-CB 3.24Å; L354-L358 VanDerWaalsContact O-CG 3.31Å; L354-L358 WeakPolarHBondContact O-CG 3.36Å; L354-L358 PolarHBondContact O-N 3.43Å; L358-K360 PolarHBondContact O-N 3.29Å; L358-C361 PolarHBondContact O-N 2.82Å; L358-K367 HydrophobicContact CD2-CB 3.69Å; L358-K367 HydrophobicContact CD2-CG 3.92Å; L358-L370 HydrophobicContact CD2-CB 4.47Å; L358-L370 HydrophobicContact CD2-CD2 4.07Å; L358-L370 HydrophobicContact CG-CD2 4.29Å
359	S	95.7	Very high	94.8	Very high	94 Å²	94	80 Å²	80	66%	0.657	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.3	176.9	71.1	0	0	0	0	114.1	K355 V356 L357	K355-S359 PolarHBondContact O-N 3.01Å; V356-S359 PolarHBondContact O-OG 3.01Å; L357-S359 PolarHBondContact O-N 3.39Å
360	K	94.5	Very high	94.6	Very high	149 Å²	149	80.5 Å²	80.5	65%	0.648	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-9.1	177.8	-65.5	-179.7	-179.7	-175.6	0	113.4	V356 L357 L358	V356-K360 WeakPolarHBondContact O-CG 3.48Å; L357-K360 WeakPolarHBondContact O-CB 3.41Å; L357-K360 PolarHBondContact O-N 3.26Å; L358-K360 PolarHBondContact O-N 3.29Å
361	C	93.7	Very high	94.5	Very high	29 Å²	29	85 Å²	85	20%	0.196	42%	0.42	C	S	.	.			trans	-66.5	136.1	174.9	-67.2	0	0	0	0	110.5	L357 L358 Q366 K367	L357-C361 PolarHBondContact O-N 3.44Å; L357-C361 PolarHBondContact O-SG 2.83Å; L358-C361 PolarHBondContact O-N 2.82Å; C361-Q366 HydrophobicContact CB-CB 3.95Å; C361-K367 HydrophobicContact CB-CG 3.53Å
362	E	94.1	Very high	94.5	Very high	185 Å²	185	82.5 Å²	82.5	86%	0.864	42%	0.416	S	S	*	.	S	Bend	trans	-88	-21.5	-177.3	-63.4	-179.6	166.4	0	0	112.5
363	S	95.1	Very high	94.3	Very high	45 Å²	45	78.4 Å²	78.4	32%	0.315	39%	0.392	S	S	.	.	S	Bend	trans	-130.1	156.1	-179.8	73.3	0	0	0	0	112	Q365 Q366 K367	S363-Q365 VanDerWaalsContact C-N 3.29Å; S363-Q365 PolarHBondContact O-N 2.91Å; S363-Q366 PolarHBondContact O-N 3.27Å; S363-Q366 WeakPolarHBondContact OG-CG 3.37Å; S363-Q366 PolarHBondContact OG-N 2.83Å; S363-K367 PolarHBondContact O-N 3.28Å
364	E	94.9	Very high	94.2	Very high	113 Å²	113	75 Å²	75	53%	0.528	38%	0.379	S	S	.	.	H	α-helix	trans	-64.7	-36.6	174.4	-158.3	61.1	-161.3	0	0	111.5	Q366 K367 D368	E364-Q366 VanDerWaalsContact C-N 3.31Å; E364-Q366 PolarHBondContact O-N 3.42Å; E364-K367 WeakPolarHBondContact O-CA 3.49Å; E364-K367 WeakPolarHBondContact O-CB 3.01Å; E364-K367 PolarHBondContact O-N 3.25Å; E364-K367 IonicContact OE2-NZ 2.79Å; E364-K367 PolarHBondContact OE2-NZ 3.41Å; E364-D368 PolarHBondContact O-N 3.13Å
365	Q	94.7	Very high	94.1	Very high	128 Å²	128	78.4 Å²	78.4	60%	0.598	40%	0.395	S	S	*	.	H	α-helix	trans	-55.5	-44.4	173.8	-177.8	-174.7	-10	0	0	112.3	S363 K367 D368 E369	S363-Q365 VanDerWaalsContact C-N 3.29Å; S363-Q365 PolarHBondContact O-N 2.91Å; Q365-K367 VanDerWaalsContact C-N 3.26Å; Q365-K367 PolarHBondContact O-N 2.91Å; Q365-D368 PolarHBondContact O-N 3.04Å; Q365-E369 HydrophobicContact CG-CG 4.48Å; Q365-E369 WeakPolarHBondContact CG-OE1 3.23Å; Q365-E369 PolarHBondContact NE2-OE1 3.29Å; Q365-E369 WeakPolarHBondContact O-CB 3.28Å; Q365-E369 WeakPolarHBondContact O-CG 3.22Å; Q365-E369 PolarHBondContact O-N 3.19Å
366	Q	92.2	Very high	94	Very high	81 Å²	81	73.3 Å²	73.3	38%	0.379	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-34.3	177.1	-76.8	173.9	-1.2	0	0	112.2	C361 S363 E364 L370	C361-Q366 HydrophobicContact CB-CB 3.95Å; S363-Q366 PolarHBondContact O-N 3.27Å; S363-Q366 WeakPolarHBondContact OG-CG 3.37Å; S363-Q366 PolarHBondContact OG-N 2.83Å; E364-Q366 VanDerWaalsContact C-N 3.31Å; E364-Q366 PolarHBondContact O-N 3.42Å; Q366-L370 WeakPolarHBondContact O-CB 3.46Å; Q366-L370 PolarHBondContact O-N 3.19Å; Q366-L370 VanDerWaalsContact O-N 3.12Å
367	K	94.5	Very high	93.8	Very high	67 Å²	67	70.6 Å²	70.6	29%	0.291	36%	0.359	S	S	.	.	H	α-helix	trans	-69	-45.9	176.1	-65.6	-177.3	-159.5	153.5	0	111.2	L358 C361 S363 E364 Q365 L370 F371	L358-K367 HydrophobicContact CD2-CB 3.69Å; L358-K367 HydrophobicContact CD2-CG 3.92Å; C361-K367 HydrophobicContact CB-CG 3.53Å; S363-K367 PolarHBondContact O-N 3.28Å; E364-K367 WeakPolarHBondContact O-CA 3.49Å; E364-K367 WeakPolarHBondContact O-CB 3.01Å; E364-K367 PolarHBondContact O-N 3.25Å; E364-K367 IonicContact OE2-NZ 2.79Å; E364-K367 PolarHBondContact OE2-NZ 3.41Å; Q365-K367 VanDerWaalsContact C-N 3.26Å; Q365-K367 PolarHBondContact O-N 2.91Å; K367-L370 PolarHBondContact O-N 3.37Å; K367-F371 VanDerWaalsContact O-CB 3.3Å; K367-F371 WeakPolarHBondContact O-CB 3.45Å; K367-F371 PolarHBondContact O-N 2.91Å
368	D	94.4	Very high	93.8	Very high	90 Å²	90	70.8 Å²	70.8	48%	0.481	36%	0.361	S	S	.	.	H	α-helix	trans	-62.5	-42.9	179.4	-68.6	-21.2	0	0	0	111.4	E364 Q365 F371 S372	E364-D368 PolarHBondContact O-N 3.13Å; Q365-D368 PolarHBondContact O-N 3.04Å; D368-F371 PolarHBondContact O-N 3.22Å; D368-S372 VanDerWaalsContact O-CB 3.28Å; D368-S372 WeakPolarHBondContact O-CB 3.47Å; D368-S372 PolarHBondContact O-N 3.07Å; D368-S372 PolarHBondContact O-OG 2.86Å
369	E	92.8	Very high	93.6	Very high	111 Å²	111	70.7 Å²	70.7	52%	0.519	36%	0.362	S	S	.	.	H	α-helix	trans	-61.5	-46.4	175.5	-74.8	172.7	-172	0	0	111.4	Q365 A373	Q365-E369 HydrophobicContact CG-CG 4.48Å; Q365-E369 WeakPolarHBondContact CG-OE1 3.23Å; Q365-E369 PolarHBondContact NE2-OE1 3.29Å; Q365-E369 WeakPolarHBondContact O-CB 3.28Å; Q365-E369 WeakPolarHBondContact O-CG 3.22Å; Q365-E369 PolarHBondContact O-N 3.19Å; E369-A373 WeakPolarHBondContact O-CB 3.35Å; E369-A373 PolarHBondContact O-N 3.3Å
370	L	92.9	Very high	93.1	Very high	22 Å²	22	70.8 Å²	70.8	12%	0.115	36%	0.355	C	S	.	.	H	α-helix	trans	-66.2	-42	178.5	179.3	62.5	0	0	0	112.2	L354 L357 L358 Q366 K367 A373 C374	L354-L370 HydrophobicContact CD1-CD2 3.84Å; L354-L370 HydrophobicContact CD1-CG 3.72Å; L357-L370 HydrophobicContact CB-CD2 3.5Å; L357-L370 HydrophobicContact CD1-CD2 4.36Å; L358-L370 HydrophobicContact CD2-CB 4.47Å; L358-L370 HydrophobicContact CD2-CD2 4.07Å; L358-L370 HydrophobicContact CG-CD2 4.29Å; Q366-L370 WeakPolarHBondContact O-CB 3.46Å; Q366-L370 PolarHBondContact O-N 3.19Å; Q366-L370 VanDerWaalsContact O-N 3.12Å; K367-L370 PolarHBondContact O-N 3.37Å; L370-A373 PolarHBondContact O-N 2.89Å; L370-C374 PolarHBondContact O-N 2.76Å; L370-C374 PolarHBondContact O-SG 3.35Å
371	F	93.6	Very high	92.6	Very high	96 Å²	96	71.4 Å²	71.4	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-50	177.5	-174.7	-95.6	0	0	0	110.7	L354 K367 D368 A373 C374 E375	L354-F371 HydrophobicContact CD2-CD2 4.29Å; K367-F371 VanDerWaalsContact O-CB 3.3Å; K367-F371 WeakPolarHBondContact O-CB 3.45Å; K367-F371 PolarHBondContact O-N 2.91Å; D368-F371 PolarHBondContact O-N 3.22Å; F371-A373 VanDerWaalsContact C-N 3.29Å; F371-A373 PolarHBondContact O-N 2.91Å; F371-C374 WeakPolarHBondContact O-CB 3.3Å; F371-C374 PolarHBondContact O-N 2.99Å; F371-E375 HydrophobicContact CD1-CG 4.01Å; F371-E375 WeakPolarHBondContact CD1-OE2 3.43Å; F371-E375 HydrophobicContact CE1-CG 3.69Å; F371-E375 WeakPolarHBondContact CE1-OE1 3.49Å; F371-E375 VanDerWaalsContact CE1-OE2 3.28Å; F371-E375 WeakPolarHBondContact CE1-OE2 3.25Å; F371-E375 HydrophobicContact CZ-CG 4.15Å; F371-E375 PolarHBondContact O-N 3.42Å
372	S	93.4	Very high	92.4	Very high	57 Å²	57	74.4 Å²	74.4	40%	0.399	37%	0.371	S	S	.	.	H	α-helix	trans	-58	-41.4	177.2	-57.1	0	0	0	0	111.7	D368 C374 E375 I376	D368-S372 VanDerWaalsContact O-CB 3.28Å; D368-S372 WeakPolarHBondContact O-CB 3.47Å; D368-S372 PolarHBondContact O-N 3.07Å; D368-S372 PolarHBondContact O-OG 2.86Å; S372-C374 VanDerWaalsContact C-N 3.35Å; S372-C374 PolarHBondContact O-N 2.93Å; S372-E375 PolarHBondContact O-N 3.4Å; S372-I376 WeakPolarHBondContact O-CG1 3.38Å; S372-I376 PolarHBondContact O-N 2.69Å; S372-I376 VanDerWaalsContact O-N 3.09Å
373	A	92.6	Very high	92.2	Very high	14 Å²	14	66.5 Å²	66.5	12%	0.116	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-39.8	175.9	0	0	0	0	0	112.3	I87 C88 E369 L370 F371	I87-A373 HydrophobicContact CG2-CB 4Å; I87-A373 WeakPolarHBondContact CG2-O 3.43Å; I87-A373 WeakPolarHBondContact O-CB 3.4Å; C88-A373 HydrophobicContact CB-CB 4Å; E369-A373 WeakPolarHBondContact O-CB 3.35Å; E369-A373 PolarHBondContact O-N 3.3Å; L370-A373 PolarHBondContact O-N 2.89Å; F371-A373 VanDerWaalsContact C-N 3.29Å; F371-A373 PolarHBondContact O-N 2.91Å
374	C	93.5	Very high	92.1	Very high	3 Å²	3	64.3 Å²	64.3	2%	0.02	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-39.8	174.1	-72.9	0	0	0	0	112.9	L354 L370 F371 S372 I376 L377 V378	L354-C374 HydrophobicContact CD2-CB 4.1Å; L370-C374 PolarHBondContact O-N 2.76Å; L370-C374 PolarHBondContact O-SG 3.35Å; F371-C374 WeakPolarHBondContact O-CB 3.3Å; F371-C374 PolarHBondContact O-N 2.99Å; S372-C374 VanDerWaalsContact C-N 3.35Å; S372-C374 PolarHBondContact O-N 2.93Å; C374-I376 VanDerWaalsContact C-N 3.29Å; C374-I376 PolarHBondContact O-N 3.14Å; C374-L377 WeakPolarHBondContact O-CB 3.47Å; C374-L377 PolarHBondContact O-N 3.37Å; C374-L377 VanDerWaalsContact O-N 3.08Å; C374-V378 WeakPolarHBondContact O-CG2 3.5Å; C374-V378 PolarHBondContact O-N 2.84Å
375	E	93.4	Very high	92.1	Very high	83 Å²	83	61 Å²	61	39%	0.388	31%	0.308	S	S	.	.	H	α-helix	trans	-57.2	-43.5	175.2	-73	-171.2	116.9	0	0	111.1	F371 S372 L377 V378 T379	F371-E375 HydrophobicContact CD1-CG 4.01Å; F371-E375 WeakPolarHBondContact CD1-OE2 3.43Å; F371-E375 HydrophobicContact CE1-CG 3.69Å; F371-E375 WeakPolarHBondContact CE1-OE1 3.49Å; F371-E375 VanDerWaalsContact CE1-OE2 3.28Å; F371-E375 WeakPolarHBondContact CE1-OE2 3.25Å; F371-E375 HydrophobicContact CZ-CG 4.15Å; F371-E375 PolarHBondContact O-N 3.42Å; S372-E375 PolarHBondContact O-N 3.4Å; E375-L377 PolarHBondContact O-N 2.86Å; E375-L377 VanDerWaalsContact O-N 3.17Å; E375-V378 PolarHBondContact O-N 3.12Å; E375-V378 VanDerWaalsContact O-N 3.12Å; E375-T379 WeakPolarHBondContact O-CB 3.19Å; E375-T379 PolarHBondContact O-N 3.27Å; E375-T379 PolarHBondContact O-OG1 3.08Å
376	I	92.6	Very high	92.1	Very high	54 Å²	54	59.1 Å²	59.1	28%	0.277	30%	0.296	S	S	.	.	H	α-helix	trans	-53.5	-39	175.1	-65	164.4	0	0	0	112.7	I87 S372 C374 Q382 M383	I87-I376 HydrophobicContact CD1-CG2 3.84Å; I87-I376 HydrophobicContact CG2-CB 4.21Å; I87-I376 HydrophobicContact CG2-CD1 4.38Å; I87-I376 HydrophobicContact CG2-CG2 4.25Å; S372-I376 WeakPolarHBondContact O-CG1 3.38Å; S372-I376 PolarHBondContact O-N 2.69Å; S372-I376 VanDerWaalsContact O-N 3.09Å; C374-I376 VanDerWaalsContact C-N 3.29Å; C374-I376 PolarHBondContact O-N 3.14Å; I376-Q382 HydrophobicContact CG2-CB 4.47Å; I376-Q382 WeakPolarHBondContact O-CB 3.34Å; I376-M383 HydrophobicContact CG2-CG 4.12Å; I376-M383 HydrophobicContact CG2-SD 3.92Å; I376-M383 VanDerWaalsContact O-CB 3.31Å; I376-M383 WeakPolarHBondContact O-CB 3.31Å; I376-M383 WeakPolarHBondContact O-CG 3.3Å; I376-M383 PolarHBondContact O-N 2.81Å
377	L	92.3	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-74.9	-29	-178	-63.1	-175.1	0	0	0	114.2	I87 C88 F91 Q341 L345 C374 E375 M383 G384	I87-L377 HydrophobicContact CB-CD2 4.38Å; I87-L377 HydrophobicContact CD1-CD2 4.49Å; I87-L377 HydrophobicContact CG2-CD2 4.35Å; C88-L377 HydrophobicContact CB-CD1 3.67Å; C88-L377 HydrophobicContact CB-CG 4.42Å; F91-L377 HydrophobicContact CB-CD1 3.95Å; F91-L377 HydrophobicContact CD2-CD1 4.34Å; Q341-L377 PolarHBondContact NE2-O 2.9Å; L345-L377 HydrophobicContact CD1-CB 3.96Å; L345-L377 HydrophobicContact CD1-CD1 4.27Å; C374-L377 WeakPolarHBondContact O-CB 3.47Å; C374-L377 PolarHBondContact O-N 3.37Å; C374-L377 VanDerWaalsContact O-N 3.08Å; E375-L377 PolarHBondContact O-N 2.86Å; E375-L377 VanDerWaalsContact O-N 3.17Å; L377-M383 HydrophobicContact CD2-SD 3.94Å; L377-G384 VanDerWaalsContact O-CA 3.29Å; L377-G384 WeakPolarHBondContact O-CA 3.43Å; L377-G384 PolarHBondContact O-N 2.76Å
378	V	93.3	Very high	92.5	Very high	24 Å²	24	53.7 Å²	53.7	15%	0.145	27%	0.271	C	S	.	.	H	α-helix	trans	-117.1	-14.8	-169.1	-56	0	0	0	0	114.7	A342 L345 I346 L350 C374 E375	A342-V378 HydrophobicContact CB-CB 4.13Å; A342-V378 WeakPolarHBondContact CB-O 3.44Å; L345-V378 HydrophobicContact CD1-CG1 4.42Å; I346-V378 HydrophobicContact CD1-CB 4.46Å; I346-V378 HydrophobicContact CG1-CG1 4.43Å; L350-V378 HydrophobicContact CD1-CG1 3.63Å; L350-V378 HydrophobicContact CD2-CG1 4.36Å; C374-V378 WeakPolarHBondContact O-CG2 3.5Å; C374-V378 PolarHBondContact O-N 2.84Å; E375-V378 PolarHBondContact O-N 3.12Å; E375-V378 VanDerWaalsContact O-N 3.12Å
379	T	92.1	Very high	92.7	Very high	40 Å²	40	49.4 Å²	49.4	25%	0.245	25%	0.248	C	C	.	.			trans	-77.6	138.2	-179.8	-64.8	0	0	0	0	111.2	E375 E381 Q382 G384	E375-T379 WeakPolarHBondContact O-CB 3.19Å; E375-T379 PolarHBondContact O-N 3.27Å; E375-T379 PolarHBondContact O-OG1 3.08Å; T379-E381 VanDerWaalsContact C-N 3.31Å; T379-E381 HydrophobicContact CG2-CB 4.36Å; T379-E381 WeakPolarHBondContact CG2-OE2 3.38Å; T379-E381 PolarHBondContact O-N 3.33Å; T379-Q382 PolarHBondContact O-N 2.78Å; T379-Q382 VanDerWaalsContact O-N 3.14Å; T379-G384 WeakPolarHBondContact O-CA 3.48Å; T379-G384 PolarHBondContact O-N 2.73Å
380	N	85.6	Confident	93	Very high	96 Å²	96	44.1 Å²	44.1	51%	0.513	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-35.4	-172	-76.1	-25	0	0	0	112.9	Q382 S385	N380-Q382 PolarHBondContact O-N 2.86Å; N380-S385 PolarHBondContact O-OG 3.43Å
381	E	83.6	Confident	93.3	Very high	161 Å²	161	43.1 Å²	43.1	75%	0.752	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-15.6	179.3	-64.2	70.3	-155.5	0	0	112.5	T379	T379-E381 VanDerWaalsContact C-N 3.31Å; T379-E381 HydrophobicContact CG2-CB 4.36Å; T379-E381 WeakPolarHBondContact CG2-OE2 3.38Å; T379-E381 PolarHBondContact O-N 3.33Å
382	Q	88	Confident	93.5	Very high	92 Å²	92	38.5 Å²	38.5	43%	0.43	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-117.3	-177.8	-68.5	172.4	-37.8	0	0	110	I376 T379 N380	I376-Q382 HydrophobicContact CG2-CB 4.47Å; I376-Q382 WeakPolarHBondContact O-CB 3.34Å; T379-Q382 PolarHBondContact O-N 2.78Å; T379-Q382 VanDerWaalsContact O-N 3.14Å; N380-Q382 PolarHBondContact O-N 2.86Å
383	M	91	Very high	93.7	Very high	19 Å²	19	35.8 Å²	35.8	9%	0.094	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-21.5	-174.8	-55.2	-179.8	82.1	0	0	113	S84 I87 I376 L377 S385 R386 F387	S84-M383 WeakPolarHBondContact OG-CE 3.3Å; I87-M383 HydrophobicContact CD1-CE 4.29Å; I87-M383 HydrophobicContact CD1-SD 3.39Å; I87-M383 WeakPolarHBondContact CD1-SD 3.22Å; I376-M383 HydrophobicContact CG2-CG 4.12Å; I376-M383 HydrophobicContact CG2-SD 3.92Å; I376-M383 VanDerWaalsContact O-CB 3.31Å; I376-M383 WeakPolarHBondContact O-CB 3.31Å; I376-M383 WeakPolarHBondContact O-CG 3.3Å; I376-M383 PolarHBondContact O-N 2.81Å; L377-M383 HydrophobicContact CD2-SD 3.94Å; M383-S385 PolarHBondContact O-N 3.34Å; M383-R386 PolarHBondContact O-N 2.87Å; M383-F387 HydrophobicContact CB-CD2 3.72Å; M383-F387 HydrophobicContact CB-CE2 4.07Å; M383-F387 HydrophobicContact CE-CD2 3.91Å; M383-F387 HydrophobicContact CE-CE1 4.05Å; M383-F387 HydrophobicContact CE-CE2 3.3Å; M383-F387 HydrophobicContact CE-CZ 3.39Å; M383-F387 HydrophobicContact CG-CD2 4.2Å; M383-F387 HydrophobicContact CG-CE2 4.02Å; M383-F387 PolarHBondContact O-N 2.88Å
384	G	93.6	Very high	93.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-42.3	-166.2	0	0	0	0	0	114.9	T340 Q341 A342 L377 T379	T340-G384 VanDerWaalsContact CB-O 3.27Å; T340-G384 WeakPolarHBondContact CB-O 3.4Å; Q341-G384 PolarHBondContact N-O 3.19Å; A342-G384 WeakPolarHBondContact CB-O 3.33Å; A342-G384 PolarHBondContact N-O 3.12Å; L377-G384 VanDerWaalsContact O-CA 3.29Å; L377-G384 WeakPolarHBondContact O-CA 3.43Å; L377-G384 PolarHBondContact O-N 2.76Å; T379-G384 WeakPolarHBondContact O-CA 3.48Å; T379-G384 PolarHBondContact O-N 2.73Å
385	S	94.3	Very high	93.7	Very high	42 Å²	42	40.7 Å²	40.7	29%	0.294	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-29.3	179.8	73.7	0	0	0	0	113.6	N380 M383 K388	N380-S385 PolarHBondContact O-OG 3.43Å; M383-S385 PolarHBondContact O-N 3.34Å; S385-K388 PolarHBondContact O-NZ 3.17Å
386	R	94.4	Very high	93.4	Very high	90 Å²	90	38.3 Å²	38.3	34%	0.34	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-39	-172	175.9	172.3	171.3	-162.4	-12	112.2	Y283 G284 R294 M383	Y283-R386 WeakPolarHBondContact CA-O 3.33Å; G284-R386 PolarHBondContact N-O 2.86Å; G284-R386 VanDerWaalsContact N-O 3.09Å; R294-R386 VanDerWaalsContact NH2-NH2 3.1Å; M383-R386 PolarHBondContact O-N 2.87Å
387	F	97.3	Very high	92.5	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.035	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.8	175.1	-77.6	-104	0	0	0	110.4	E195 I281 D282 Y283 T340 Q341 M383	E195-F387 HydrophobicContact CG-CE1 3.61Å; E195-F387 HydrophobicContact CG-CZ 4.26Å; I281-F387 HydrophobicContact CG2-CD1 4.36Å; D282-F387 WeakPolarHBondContact O-CA 3.19Å; Y283-F387 AromaticContact CD1-CE1 3.9Å; Y283-F387 HydrophobicContact CD1-CE1 3.9Å; Y283-F387 HydrophobicContact CD1-CE2 4.34Å; Y283-F387 AromaticContact CD1-CZ 3.68Å; Y283-F387 HydrophobicContact CD1-CZ 3.68Å; Y283-F387 HydrophobicContact CG-CZ 4.32Å; T340-F387 CarbonylContact C-O 3.54Å; T340-F387 WeakPolarHBondContact CA-O 3.43Å; Q341-F387 HydrophobicContact CB-CB 3.67Å; Q341-F387 HydrophobicContact CG-CB 4.42Å; Q341-F387 PolarHBondContact N-O 2.64Å; M383-F387 HydrophobicContact CB-CD2 3.72Å; M383-F387 HydrophobicContact CB-CE2 4.07Å; M383-F387 HydrophobicContact CE-CD2 3.91Å; M383-F387 HydrophobicContact CE-CE1 4.05Å; M383-F387 HydrophobicContact CE-CE2 3.3Å; M383-F387 HydrophobicContact CE-CZ 3.39Å; M383-F387 HydrophobicContact CG-CD2 4.2Å; M383-F387 HydrophobicContact CG-CE2 4.02Å; M383-F387 PolarHBondContact O-N 2.88Å
388	K	98.2	Very high	91.4	Very high	26 Å²	26	49.7 Å²	49.7	11%	0.113	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.9	176.6	-46.4	-64	-170.6	-174.1	0	110.4	I281 D282 F319 P338 V339 T340 S385	I281-K388 WeakPolarHBondContact CA-O 3.32Å; D282-K388 PolarHBondContact N-O 3.47Å; D282-K388 PolarHBondContact O-N 2.87Å; F319-K388 HydrophobicContact CD1-CB 4.19Å; F319-K388 HydrophobicContact CD2-CB 3.85Å; F319-K388 HydrophobicContact CD2-CG 3.81Å; F319-K388 HydrophobicContact CE1-CB 3.91Å; F319-K388 HydrophobicContact CE2-CB 3.56Å; F319-K388 HydrophobicContact CE2-CG 3.81Å; F319-K388 HydrophobicContact CG-CB 4.16Å; F319-K388 HydrophobicContact CG-CG 4.38Å; F319-K388 HydrophobicContact CZ-CB 3.6Å; F319-K388 HydrophobicContact CZ-CG 4.37Å; P338-K388 HydrophobicContact CB-CB 4.21Å; V339-K388 CarbonylContact O-C 3.55Å; V339-K388 VanDerWaalsContact O-CA 3.22Å; V339-K388 WeakPolarHBondContact O-CA 3.49Å; T340-K388 HydrophobicContact CG2-CD 4.41Å; S385-K388 PolarHBondContact O-NZ 3.17Å
389	F	98.6	Very high	90.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.5	178.9	-81.8	-120.5	0	0	0	108.7	F91 I95 L279 I281 P338 V339 Q341 F344 F410	F91-F389 HydrophobicContact CE2-CE2 4.4Å; F91-F389 AromaticContact CE2-CZ 3.7Å; F91-F389 HydrophobicContact CE2-CZ 3.7Å; F91-F389 AromaticContact CZ-CZ 3.88Å; F91-F389 HydrophobicContact CZ-CZ 3.88Å; I95-F389 HydrophobicContact CD1-CE1 3.8Å; I95-F389 HydrophobicContact CD1-CZ 4.43Å; L279-F389 HydrophobicContact CD1-CD1 4.15Å; L279-F389 HydrophobicContact CD2-CD1 4.49Å; L279-F389 HydrophobicContact CD2-CE1 4.47Å; L279-F389 HydrophobicContact CG-CD1 4.47Å; I281-F389 HydrophobicContact CB-CE2 4.33Å; I281-F389 HydrophobicContact CB-CZ 4.37Å; I281-F389 HydrophobicContact CD1-CD1 3.91Å; I281-F389 HydrophobicContact CD1-CE1 3.3Å; I281-F389 HydrophobicContact CD1-CE2 4.33Å; I281-F389 HydrophobicContact CD1-CZ 3.55Å; I281-F389 HydrophobicContact CG1-CD1 3.67Å; I281-F389 HydrophobicContact CG1-CD2 4.21Å; I281-F389 HydrophobicContact CG1-CE1 3.55Å; I281-F389 HydrophobicContact CG1-CE2 4.08Å; I281-F389 HydrophobicContact CG1-CG 3.99Å; I281-F389 HydrophobicContact CG1-CZ 3.77Å; I281-F389 HydrophobicContact CG2-CD2 3.84Å; I281-F389 HydrophobicContact CG2-CE1 4.36Å; I281-F389 HydrophobicContact CG2-CE2 3.37Å; I281-F389 HydrophobicContact CG2-CG 4.48Å; I281-F389 HydrophobicContact CG2-CZ 3.68Å; P338-F389 VanDerWaalsContact CA-O 3.29Å; P338-F389 WeakPolarHBondContact CA-O 3.45Å; V339-F389 HydrophobicContact CG2-CB 3.96Å; V339-F389 PolarHBondContact N-O 2.66Å; V339-F389 PolarHBondContact O-N 3.37Å; Q341-F389 HydrophobicContact CB-CD2 4.08Å; Q341-F389 HydrophobicContact CB-CE2 3.63Å; Q341-F389 HydrophobicContact CG-CE2 3.65Å; Q341-F389 HydrophobicContact CG-CZ 4.27Å; F344-F389 HydrophobicContact CB-CB 4.24Å; F344-F389 HydrophobicContact CB-CD1 3.89Å; F344-F389 HydrophobicContact CB-CD2 4.26Å; F344-F389 HydrophobicContact CB-CE1 4.3Å; F344-F389 HydrophobicContact CB-CG 3.87Å; F344-F389 AromaticContact CD1-CD1 3.4Å; F344-F389 HydrophobicContact CD1-CD1 3.4Å; F344-F389 AromaticContact CD1-CE1 3.21Å; F344-F389 HydrophobicContact CD1-CE1 3.21Å; F344-F389 HydrophobicContact CD1-CG 4.23Å; F344-F389 AromaticContact CD1-CZ 3.94Å; F344-F389 HydrophobicContact CD1-CZ 3.94Å; F344-F389 HydrophobicContact CD2-CB 4.28Å; F344-F389 AromaticContact CD2-CD1 3.65Å; F344-F389 HydrophobicContact CD2-CD1 3.65Å; F344-F389 HydrophobicContact CD2-CE1 4.33Å; F344-F389 HydrophobicContact CD2-CG 4.21Å; F344-F389 AromaticContact CE1-CD1 3.77Å; F344-F389 HydrophobicContact CE1-CD1 3.77Å; F344-F389 AromaticContact CE1-CE1 3.48Å; F344-F389 HydrophobicContact CE1-CE1 3.48Å; F344-F389 VanDerWaalsContact CE1-CE1 3.48Å; F344-F389 HydrophobicContact CE1-CZ 4.47Å; F344-F389 HydrophobicContact CE2-CD1 4.01Å; F344-F389 HydrophobicContact CG-CB 4.31Å; F344-F389 AromaticContact CG-CD1 3.33Å; F344-F389 HydrophobicContact CG-CD1 3.33Å; F344-F389 AromaticContact CG-CE1 3.69Å; F344-F389 HydrophobicContact CG-CE1 3.69Å; F344-F389 AromaticContact CG-CG 3.83Å; F344-F389 HydrophobicContact CG-CG 3.83Å; F344-F389 HydrophobicContact CG-CZ 4.45Å; F344-F389 HydrophobicContact CZ-CD1 4.05Å; F344-F389 HydrophobicContact CZ-CE1 4.16Å; F389-F410 HydrophobicContact CB-CE1 4.27Å; F389-F410 HydrophobicContact CB-CZ 4.14Å; F389-F410 WeakPolarHBondContact O-CE1 3.43Å
390	V	98.7	Very high	88.6	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.5	168.9	163.8	0	0	0	0	108.8	L280 F319 L322 L335 H336 P338 I392	L280-V390 PolarHBondContact N-O 2.85Å; L280-V390 PolarHBondContact O-N 3.27Å; F319-V390 HydrophobicContact CD1-CB 4.48Å; F319-V390 HydrophobicContact CD1-CG2 3.53Å; F319-V390 HydrophobicContact CE1-CB 4.34Å; F319-V390 HydrophobicContact CE1-CG2 3.79Å; L322-V390 HydrophobicContact CD2-CB 4.43Å; L322-V390 HydrophobicContact CD2-CG2 4.42Å; L335-V390 HydrophobicContact CD1-CG1 3.44Å; L335-V390 VanDerWaalsContact CD1-CG1 3.44Å; H336-V390 WeakPolarHBondContact O-CA 3.37Å; P338-V390 HydrophobicContact CB-CG2 3.84Å; V390-I392 HydrophobicContact CG1-CG1 4.46Å
391	A	98.7	Very high	87.2	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143	169.2	0	0	0	0	0	111.4	W98 A278 L279 H336 L407 F410	W98-A391 HydrophobicContact CH2-CB 4.21Å; W98-A391 HydrophobicContact CZ2-CB 3.73Å; A278-A391 CarbonylContact O-C 3.5Å; A278-A391 VanDerWaalsContact O-CA 3.23Å; A278-A391 WeakPolarHBondContact O-CA 3.5Å; L279-A391 HydrophobicContact CD1-CB 4.03Å; H336-A391 HydrophobicContact CB-CB 4.22Å; H336-A391 PolarHBondContact N-O 3.09Å; H336-A391 PolarHBondContact O-N 2.74Å; A391-L407 HydrophobicContact CB-CD2 4Å; A391-F410 HydrophobicContact CB-CD2 4.23Å; A391-F410 HydrophobicContact CB-CE1 4.22Å; A391-F410 HydrophobicContact CB-CE2 3.39Å; A391-F410 HydrophobicContact CB-CZ 3.4Å; A391-F410 VanDerWaalsContact CB-CZ 3.4Å
392	I	98.5	Very high	85.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.7	171	-51.7	168.6	0	0	0	106.8	I271 S277 A278 L280 V326 V333 R334 V390	I271-I392 HydrophobicContact CD1-CB 4Å; I271-I392 HydrophobicContact CD1-CG2 3.84Å; S277-I392 CarbonylContact C-O 3.51Å; S277-I392 VanDerWaalsContact CA-O 3.26Å; S277-I392 WeakPolarHBondContact CA-O 3.21Å; A278-I392 HydrophobicContact CB-CB 4.18Å; A278-I392 HydrophobicContact CB-CD1 4.39Å; A278-I392 PolarHBondContact N-O 2.9Å; A278-I392 PolarHBondContact O-N 3.36Å; L280-I392 HydrophobicContact CD1-CD1 4.07Å; V326-I392 HydrophobicContact CG1-CD1 4.38Å; V326-I392 HydrophobicContact CG1-CG1 4.33Å; V326-I392 HydrophobicContact CG2-CD1 3.57Å; V326-I392 HydrophobicContact CG2-CG1 4.15Å; V333-I392 HydrophobicContact CB-CG2 3.79Å; V333-I392 HydrophobicContact CG1-CG2 4.21Å; V333-I392 HydrophobicContact CG2-CG2 3.87Å; R334-I392 VanDerWaalsContact O-CA 3.32Å; R334-I392 WeakPolarHBondContact O-CA 3.4Å; V390-I392 HydrophobicContact CG1-CG1 4.46Å
393	T	97.4	Very high	84.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.2	-179.8	65.4	0	0	0	0	110	E102 V333 R334 H336 L407	E102-T393 WeakPolarHBondContact OE2-CG2 3.27Å; V333-T393 CarbonylContact C-O 3.57Å; V333-T393 VanDerWaalsContact CA-O 3.3Å; V333-T393 WeakPolarHBondContact CA-O 3.38Å; V333-T393 WeakPolarHBondContact CB-O 3.44Å; R334-T393 PolarHBondContact N-O 2.87Å; R334-T393 PolarHBondContact O-N 3.27Å; H336-T393 PolarHBondContact NE2-OG1 3.36Å; T393-L407 HydrophobicContact CG2-CD2 4.28Å
394	P	95.6	Very high	82.5	Confident	10 Å²	10	59.6 Å²	59.6	7%	0.065	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	156.2	172.6	29.7	-38.8	0	0	0	109.9	Q106 I271 G276 L396	Q106-P394 HydrophobicContact CG-CG 4.37Å; I271-P394 HydrophobicContact CG2-CB 4.08Å; I271-P394 HydrophobicContact CG2-CG 4.49Å; G276-P394 WeakPolarHBondContact O-CD 3.29Å; P394-L396 HydrophobicContact CB-CD2 4.21Å; P394-L396 HydrophobicContact CG-CD2 3.72Å; P394-L396 HydrophobicContact CG-CG 4.31Å
395	E	91.7	Very high	81.1	Confident	109 Å²	109	62.3 Å²	62.3	51%	0.509	36%	0.356	S	S	.	.			trans	-77.4	113.5	159.3	-175	167.8	-149.4	0	0	108.5	K332 R334	K332-E395 HydrophobicContact CB-CB 4.44Å; K332-E395 PolarHBondContact O-N 2.94Å; R334-E395 IonicContact NH2-OE1 3.75Å
396	L	85.4	Confident	80.5	Confident	34 Å²	34	67.7 Å²	67.7	18%	0.178	38%	0.376	C	S	.	.			trans	-93.9	148.6	178	-58.1	-178.3	0	0	0	110.5	R105 Q106 P394 S398 D399	R105-L396 HydrophobicContact CG-CD1 4.2Å; Q106-L396 HydrophobicContact CG-CD1 4.42Å; Q106-L396 HydrophobicContact CG-CD2 4.45Å; P394-L396 HydrophobicContact CB-CD2 4.21Å; P394-L396 HydrophobicContact CG-CD2 3.72Å; P394-L396 HydrophobicContact CG-CG 4.31Å; L396-S398 PolarHBondContact O-N 2.93Å; L396-D399 WeakPolarHBondContact CA-OD2 3.37Å; L396-D399 WeakPolarHBondContact CB-OD2 3.41Å; L396-D399 PolarHBondContact N-OD2 2.84Å; L396-D399 WeakPolarHBondContact O-CB 3.43Å; L396-D399 PolarHBondContact O-N 3.09Å
397	E	75	Confident	80.4	Confident	205 Å²	205	63.5 Å²	63.5	96%	0.958	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-28.5	176.9	-63.9	-178.5	170.9	0	0	113	D399	E397-D399 PolarHBondContact O-N 3.43Å
398	S	69.4	Low	80.1	Confident	87 Å²	87	65.8 Å²	65.8	61%	0.608	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.2	176.1	53.4	0	0	0	0	113.7	L396 S400	L396-S398 PolarHBondContact O-N 2.93Å; S398-S400 PolarHBondContact O-N 2.87Å
399	D	67.3	Low	80	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.134	37%	0.371	C	S	.	.			trans	-79.3	97.7	-174.1	-55.2	-38.7	0	0	0	109.2	R334 L396 E397 V401 Q405	R334-D399 IonicContact CZ-OD2 3.63Å; R334-D399 VanDerWaalsContact NH1-CB 3.29Å; R334-D399 IonicContact NH1-OD1 3.49Å; R334-D399 IonicContact NH1-OD2 2.72Å; R334-D399 PolarHBondContact NH1-OD2 3.44Å; R334-D399 IonicContact NH2-OD2 2.77Å; R334-D399 PolarHBondContact NH2-OD2 3.17Å; L396-D399 WeakPolarHBondContact CA-OD2 3.37Å; L396-D399 WeakPolarHBondContact CB-OD2 3.41Å; L396-D399 PolarHBondContact N-OD2 2.84Å; L396-D399 WeakPolarHBondContact O-CB 3.43Å; L396-D399 PolarHBondContact O-N 3.09Å; E397-D399 PolarHBondContact O-N 3.43Å; D399-V401 PolarHBondContact O-N 3.13Å; D399-Q405 PolarHBondContact OD1-NE2 3.19Å
400	S	58	Low	79.9	Confident	88 Å²	88	65.5 Å²	65.5	62%	0.615	38%	0.375	S	S	*	.			trans	-61	132.8	178.6	-50.5	0	0	0	0	109.9	S398 G402 C403	S398-S400 PolarHBondContact O-N 2.87Å; S400-G402 PolarHBondContact O-N 3.04Å; S400-C403 PolarHBondContact O-N 3.07Å
401	V	56	Low	79.6	Confident	160 Å²	160	67 Å²	67	97%	0.97	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	113.7	174.2	-178.4	0	0	0	0	109	D399	D399-V401 PolarHBondContact O-N 3.13Å
402	G	53.2	Low	79.2	Confident	81 Å²	81	69.5 Å²	69.5	84%	0.835	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.2	-0.3	173.7	0	0	0	0	0	117.1	S400	S400-G402 PolarHBondContact O-N 3.04Å
403	C	52.9	Low	78.7	Confident	101 Å²	101	73.6 Å²	73.6	68%	0.682	42%	0.422	S	S	*	.			trans	-89.9	114.6	169.1	-152.1	0	0	0	0	109	S400 Q405	S400-C403 PolarHBondContact O-N 3.07Å; C403-Q405 PolarHBondContact O-N 3.31Å
404	E	57.7	Low	78.2	Confident	186 Å²	186	78.9 Å²	78.9	87%	0.869	46%	0.459	S	S	*	.			trans	-60.3	108.6	169.8	-76.9	-172.5	168.3	0	0	108.4	Q406	E404-Q406 PolarHBondContact O-N 3.42Å
405	Q	65.3	Low	77.7	Confident	57 Å²	57	82.4 Å²	82.4	27%	0.266	50%	0.497	S	S	.	.			trans	-71.4	122.2	-173.5	-170.4	169.8	34.1	0	0	109.9	D399 C403 L407	D399-Q405 PolarHBondContact OD1-NE2 3.19Å; C403-Q405 PolarHBondContact O-N 3.31Å; Q405-L407 PolarHBondContact O-N 3.15Å
406	Q	81.9	Confident	77.5	Confident	154 Å²	154	78.1 Å²	78.1	72%	0.72	48%	0.478	S	S	*	.			trans	-79.2	87.5	177.7	-57.3	-165.5	-23.4	0	0	110.2	E404 T411	E404-Q406 PolarHBondContact O-N 3.42Å; Q406-T411 VanDerWaalsContact CA-OG1 3.27Å; Q406-T411 WeakPolarHBondContact CA-OG1 3.33Å; Q406-T411 HydrophobicContact CB-CG2 3.92Å; Q406-T411 HydrophobicContact CG-CG2 3.85Å
407	L	91.4	Very high	77.6	Confident	3 Å²	3	81.5 Å²	81.5	2%	0.016	50%	0.502	C	S	.	.			trans	-79.9	122.9	171.7	-177.2	70.6	0	0	0	109.2	W98 E102 H336 A391 T393 Q405 G409 F410 T411	W98-L407 HydrophobicContact CZ2-CD2 4.25Å; E102-L407 WeakPolarHBondContact OE1-CD1 3.43Å; H336-L407 HydrophobicContact CB-CD2 3.96Å; A391-L407 HydrophobicContact CB-CD2 4Å; T393-L407 HydrophobicContact CG2-CD2 4.28Å; Q405-L407 PolarHBondContact O-N 3.15Å; L407-G409 PolarHBondContact O-N 2.84Å; L407-F410 HydrophobicContact CB-CB 4.28Å; L407-F410 HydrophobicContact CD2-CB 4.37Å; L407-F410 HydrophobicContact CD2-CD2 3.45Å; L407-F410 VanDerWaalsContact CD2-CD2 3.45Å; L407-F410 HydrophobicContact CD2-CE2 3.99Å; L407-F410 HydrophobicContact CD2-CG 4.09Å; L407-F410 HydrophobicContact CG-CD2 3.98Å; L407-F410 CarbonylContact O-C 3.5Å; L407-F410 PolarHBondContact O-N 2.81Å; L407-T411 PolarHBondContact N-OG1 2.83Å; L407-T411 PolarHBondContact O-N 3.47Å; L407-T411 VanDerWaalsContact O-N 3.08Å; L407-T411 PolarHBondContact O-OG1 2.51Å
408	P	92.2	Very high	78.1	Confident	56 Å²	56	75.2 Å²	75.2	36%	0.364	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-51.6	137.3	177.9	-28.2	35.9	0	0	0	112.4	W98 M348 F410	W98-P408 PolarHBondContact NE1-O 2.7Å; M348-P408 VanDerWaalsContact SD-C 3.55Å; M348-P408 HydrophobicContact SD-CB 3.59Å; M348-P408 VanDerWaalsContact SD-CB 3.59Å; P408-F410 PolarHBondContact O-N 2.97Å; P408-F410 VanDerWaalsContact O-N 3.15Å
409	G	95.8	Very high	78.8	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	-26.4	-175.7	0	0	0	0	0	114.9	Y343 F344 L407	Y343-G409 VanDerWaalsContact CD1-O 3.31Å; Y343-G409 WeakPolarHBondContact CD1-O 3.16Å; Y343-G409 VanDerWaalsContact CE1-O 3.3Å; Y343-G409 WeakPolarHBondContact CE1-O 3.25Å; F344-G409 WeakPolarHBondContact CA-O 3.43Å; L407-G409 PolarHBondContact O-N 2.84Å
410	F	96.1	Very high	79.1	Confident	20 Å²	20	80 Å²	80	9%	0.088	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-5	176	-67.9	-89.7	0	0	0	113.3	L279 H336 V339 F344 F389 A391 L407 P408	L279-F410 HydrophobicContact CD1-CE2 3.98Å; L279-F410 HydrophobicContact CD1-CZ 3.85Å; H336-F410 HydrophobicContact CB-CB 4.18Å; H336-F410 HydrophobicContact CB-CD1 3.69Å; H336-F410 HydrophobicContact CB-CD2 4.33Å; H336-F410 HydrophobicContact CB-CE1 4.11Å; H336-F410 HydrophobicContact CB-CG 3.8Å; H336-F410 WeakPolarHBondContact O-CE1 3.48Å; V339-F410 HydrophobicContact CG1-CD1 4.11Å; V339-F410 HydrophobicContact CG2-CD1 3.76Å; V339-F410 HydrophobicContact CG2-CE1 3.81Å; F344-F410 HydrophobicContact CD2-CD2 4.06Å; F344-F410 AromaticContact CD2-CE2 3.74Å; F344-F410 HydrophobicContact CD2-CE2 3.74Å; F344-F410 HydrophobicContact CD2-CZ 4.06Å; F344-F410 AromaticContact CE2-CD2 3.88Å; F344-F410 HydrophobicContact CE2-CD2 3.88Å; F344-F410 AromaticContact CE2-CE2 3.42Å; F344-F410 HydrophobicContact CE2-CE2 3.42Å; F344-F410 VanDerWaalsContact CE2-CE2 3.42Å; F344-F410 HydrophobicContact CE2-CZ 4.09Å; F389-F410 HydrophobicContact CB-CE1 4.27Å; F389-F410 HydrophobicContact CB-CZ 4.14Å; F389-F410 WeakPolarHBondContact O-CE1 3.43Å; A391-F410 HydrophobicContact CB-CD2 4.23Å; A391-F410 HydrophobicContact CB-CE1 4.22Å; A391-F410 HydrophobicContact CB-CE2 3.39Å; A391-F410 HydrophobicContact CB-CZ 3.4Å; A391-F410 VanDerWaalsContact CB-CZ 3.4Å; L407-F410 HydrophobicContact CB-CB 4.28Å; L407-F410 HydrophobicContact CD2-CB 4.37Å; L407-F410 HydrophobicContact CD2-CD2 3.45Å; L407-F410 VanDerWaalsContact CD2-CD2 3.45Å; L407-F410 HydrophobicContact CD2-CE2 3.99Å; L407-F410 HydrophobicContact CD2-CG 4.09Å; L407-F410 HydrophobicContact CG-CD2 3.98Å; L407-F410 CarbonylContact O-C 3.5Å; L407-F410 PolarHBondContact O-N 2.81Å; P408-F410 PolarHBondContact O-N 2.97Å; P408-F410 VanDerWaalsContact O-N 3.15Å
411	T	92.8	Very high	78.9	Confident	32 Å²	32	80.9 Å²	80.9	20%	0.196	49%	0.494	C	S	.	.	B	Isolated β-bridge	trans	-122.8	142.4	176	-51.8	0	0	0	0	109.1	Q406 L407 L413	Q406-T411 VanDerWaalsContact CA-OG1 3.27Å; Q406-T411 WeakPolarHBondContact CA-OG1 3.33Å; Q406-T411 HydrophobicContact CB-CG2 3.92Å; Q406-T411 HydrophobicContact CG-CG2 3.85Å; L407-T411 PolarHBondContact N-OG1 2.83Å; L407-T411 PolarHBondContact O-N 3.47Å; L407-T411 VanDerWaalsContact O-N 3.08Å; L407-T411 PolarHBondContact O-OG1 2.51Å; T411-L413 PolarHBondContact O-N 3.12Å
412	P	90.2	Very high	78.3	Confident	52 Å²	52	80.5 Å²	80.5	34%	0.338	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-60.2	129.9	177	-21	32.6	0	0	0	111.8	Y343 Y418	Y343-P412 WeakPolarHBondContact OH-CD 3.41Å; Y343-P412 VanDerWaalsContact OH-CG 3.27Å; Y343-P412 WeakPolarHBondContact OH-CG 3.3Å; P412-Y418 WeakPolarHBondContact CB-O 3.46Å
413	L	86.8	Confident	77.6	Confident	85 Å²	85	82.3 Å²	82.3	45%	0.445	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-86.6	133.6	170.6	-179.4	67.9	0	0	0	109.3	N347 T411 G415 T416	N347-L413 HydrophobicContact CB-CB 4.38Å; N347-L413 PolarHBondContact OD1-N 3.05Å; T411-L413 PolarHBondContact O-N 3.12Å; L413-G415 PolarHBondContact O-N 3.47Å; L413-T416 HydrophobicContact CB-CG2 3.81Å; L413-T416 HydrophobicContact CD2-CG2 4.31Å; L413-T416 HydrophobicContact CG-CG2 4.31Å; L413-T416 WeakPolarHBondContact O-CB 3.2Å; L413-T416 WeakPolarHBondContact O-CG2 3.05Å; L413-T416 PolarHBondContact O-N 3.28Å; L413-T416 VanDerWaalsContact O-N 3.12Å; L413-T416 PolarHBondContact O-OG1 3.08Å
414	S	86.6	Confident	76.8	Confident	111 Å²	111	87.3 Å²	87.3	78%	0.776	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	137	177.6	-54.6	0	0	0	0	111.8	T416	S414-T416 VanDerWaalsContact C-N 3.3Å
415	G	85.4	Confident	77.7	Confident	84 Å²	84	82.4 Å²	82.4	87%	0.866	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	1.3	-178.7	0	0	0	0	0	115	L413	L413-G415 PolarHBondContact O-N 3.47Å
416	T	87.6	Confident	78.4	Confident	20 Å²	20	83.7 Å²	83.7	12%	0.123	51%	0.508	C	S	.	.	S	Bend	trans	-87.4	161.2	167.6	74.7	0	0	0	0	111.2	I346 N347 L413 S414 Y418 A419	I346-T416 HydrophobicContact CG2-CG2 3.83Å; N347-T416 PolarHBondContact OD1-OG1 3.3Å; L413-T416 HydrophobicContact CB-CG2 3.81Å; L413-T416 HydrophobicContact CD2-CG2 4.31Å; L413-T416 HydrophobicContact CG-CG2 4.31Å; L413-T416 WeakPolarHBondContact O-CB 3.2Å; L413-T416 WeakPolarHBondContact O-CG2 3.05Å; L413-T416 PolarHBondContact O-N 3.28Å; L413-T416 VanDerWaalsContact O-N 3.12Å; L413-T416 PolarHBondContact O-OG1 3.08Å; S414-T416 VanDerWaalsContact C-N 3.3Å; T416-Y418 PolarHBondContact O-N 3.11Å; T416-Y418 PolarHBondContact OG1-N 3.3Å; T416-A419 WeakPolarHBondContact O-CB 3.41Å; T416-A419 PolarHBondContact O-N 3.34Å; T416-A419 VanDerWaalsContact O-N 3.14Å
417	P	87.1	Confident	78.2	Confident	104 Å²	104	79.8 Å²	79.8	68%	0.675	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-11	174	-23.8	34.8	0	0	0	114.9
418	Y	87.3	Confident	77.4	Confident	74 Å²	74	84.4 Å²	84.4	29%	0.29	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-11.1	-178.9	-56.8	-68.5	0	0	0	113.5	Y343 I346 P412 T416 Q420	Y343-Y418 AromaticContact CD2-CD1 3.51Å; Y343-Y418 HydrophobicContact CD2-CD1 3.51Å; Y343-Y418 AromaticContact CD2-CD2 3.95Å; Y343-Y418 HydrophobicContact CD2-CD2 3.95Å; Y343-Y418 AromaticContact CD2-CE1 3.88Å; Y343-Y418 HydrophobicContact CD2-CE1 3.88Å; Y343-Y418 HydrophobicContact CD2-CE2 4.29Å; Y343-Y418 AromaticContact CD2-CG 3.54Å; Y343-Y418 HydrophobicContact CD2-CG 3.54Å; Y343-Y418 AromaticContact CE2-CD1 4Å; Y343-Y418 HydrophobicContact CE2-CD1 4Å; Y343-Y418 HydrophobicContact CE2-CD2 4.47Å; Y343-Y418 AromaticContact CE2-CG 3.82Å; Y343-Y418 HydrophobicContact CE2-CG 3.82Å; Y343-Y418 HydrophobicContact CG-CD2 4.47Å; Y343-Y418 HydrophobicContact CG-CG 4.46Å; I346-Y418 HydrophobicContact CB-CD2 4.34Å; I346-Y418 HydrophobicContact CB-CE2 3.9Å; I346-Y418 HydrophobicContact CD1-CE2 3.72Å; I346-Y418 HydrophobicContact CG1-CE2 4.38Å; I346-Y418 HydrophobicContact CG2-CD2 3.97Å; I346-Y418 HydrophobicContact CG2-CE2 3.89Å; P412-Y418 WeakPolarHBondContact CB-O 3.46Å; T416-Y418 PolarHBondContact O-N 3.11Å; T416-Y418 PolarHBondContact OG1-N 3.3Å; Y418-Q420 PolarHBondContact O-N 2.92Å
419	A	83.8	Confident	76.5	Confident	32 Å²	32	86.1 Å²	86.1	26%	0.264	53%	0.534	S	S	.	.	S	Bend	trans	-58.2	130.6	171.2	0	0	0	0	0	107.8	T416 S421	T416-A419 WeakPolarHBondContact O-CB 3.41Å; T416-A419 PolarHBondContact O-N 3.34Å; T416-A419 VanDerWaalsContact O-N 3.14Å; A419-S421 PolarHBondContact O-N 3.29Å; A419-S421 VanDerWaalsContact O-N 3.11Å
420	Q	72.3	Confident	75.2	Confident	179 Å²	179	91.9 Å²	91.9	84%	0.836	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-54	125.7	168	-70.2	-174.2	-5.3	0	0	106.3	Y418 D422	Y418-Q420 PolarHBondContact O-N 2.92Å; Q420-D422 PolarHBondContact O-N 2.79Å
421	S	54.4	Low	73.7	Confident	107 Å²	107	97 Å²	97	75%	0.748	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-53	119.3	166.4	53	0	0	0	0	105.3	A419 S423	A419-S421 PolarHBondContact O-N 3.29Å; A419-S421 VanDerWaalsContact O-N 3.11Å; S421-S423 PolarHBondContact O-N 3.46Å
422	D	44.6	Very low	72.2	Confident	152 Å²	152	102 Å²	102	81%	0.813	64%	0.636	S	S	*	*			trans	-42.2	112.2	170	-71.4	-39.5	0	0	0	106.2	Q420 V424	Q420-D422 PolarHBondContact O-N 2.79Å; D422-V424 PolarHBondContact O-N 3.38Å
423	S	38.5	Very low	70.7	Confident	119 Å²	119	106.2 Å²	106.2	83%	0.832	66%	0.66	S	S	*	*			trans	-62.9	96.3	170.7	52.4	0	0	0	0	105.1	S421	S421-S423 PolarHBondContact O-N 3.46Å
424	V	34.4	Very low	69.3	Low	207 Å²	207	108.1 Å²	108.1	100%	1.255	68%	0.68	S	S	*	*			trans	-63.2	0	170	179.2	0	0	0	0	109.2	D422	D422-V424 PolarHBondContact O-N 3.38Å

Retrieved 424 of 424 residues in 913.2 ms (Link to these results)

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